SCHEMBL2942313

SCHEMBL2942313

COc1cc(OC)cc(-c2cc3cc4nc(cc5ccc(cc6nc(cc2[nH]3)C=C6)[nH]5)C=C4)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 2/20 0.36
▸ ABCB1 P08183 2/20 0.36
▸ BCR P11274 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ STAT3 P40763 1/20 0.35
▸ STAT1 P42224 1/20 0.35
▸ CYP1A2 P05177 4/20 0.34
▸ CYP2C9 P11712 4/20 0.34
▸ CYP2B6 P20813 4/20 0.34
▸ CYP2E1 P05181 3/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ CYP2C8 P10632 3/20 0.34
▸ CYP2D6 P10635 3/20 0.34
▸ CYP2C19 P33261 3/20 0.34
▸ CYP1A1 P04798 2/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9590022 0.89 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL2948397 0.88 AURKA (0.44) ALDH1A1HPGDSMN1; SMN2HSD17B10STAT3
SCHEMBL28843869 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL28249687 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL28098901 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL8003382 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL27968431 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL28442526 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
SCHEMBL27910482 0.88 NPC1 (0.40) ABL1ABCB1BCRALDH1A1HPGD
Hydrochloric Acid SCHEMBL29089406 0.86 AURKA (0.39) ALDH1A1HPGDSMN1; SMN2GAAMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112663086-A Ni-N-C monatomic catalyst and preparation method and application thereof 中科院过程工程研究所南京绿色制造产业创新研究院 2021-04-16 — — CN claimed
CN-116465945-A Ion-selective membrane, ion-selective electrode, ion sensor, sample testing device, and complex compound 佳能株式会社 2023-07-21 — — CN disclosed
CN-112004845-B Resin composition, laminate, semiconductor wafer with resin composition layer, substrate, and semiconductor device 三菱瓦斯化学株式会社 2022-05-31 — — CN disclosed
CN-112088192-B Color material dispersion liquid, composition, film, optical filter, and display device 大日本印刷株式会社 2022-05-13 — — CN disclosed
CN-112663086-A Ni-N-C monatomic catalyst and preparation method and application thereof 中科院过程工程研究所南京绿色制造产业创新研究院 2021-04-16 — — CN disclosed
CN-112088192-A Color material dispersion liquid, composition, film, optical filter, and display device 大日本印刷株式会社 2020-12-15 — — CN disclosed
CN-112004845-A Resin composition, laminate, semiconductor wafer with resin composition layer, substrate for mounting semiconductor with resin composition layer, and semiconductor device 三菱瓦斯化学株式会社 2020-11-27 — — CN disclosed
EP-2379109-B1 COMBINATION OF PHOTODYNAMIC THERAPY AND ANTI-VEGF AGENTS IN THE TREATMENT OF UNWANTED CHOROIDAL NEOVASCULATURE BAUSCH HEALTH COMPANIES INC (CA) 2020-10-07 — — EP disclosed
US-10696863-B2 Additives for curable liquid compositions DURA CHEMICALS, INC. (US) 2020-06-30 — — US disclosed
US-10632096-B2 Method of quenching singlet and triplet excited states of photodegradable pigments, such as porphyrin compounds, particularly protoporphyrin IX, with conjugated fused tricyclic compounds having electron withdrawing groups, to reduce generation of singlet oxygen HallStar Beauty and Personal Care Innovations Company (US) 2020-04-28 — — US disclosed
US-20030099596-A1 Treatment of macular edema BAUSCH HEALTH IRELAND LIMITED (IE) 2003-05-29 — — US disclosed
US-20030087889-A1 Photodynamic therapy of occult age-related macular degeneration BAUSCH HEALTH COMPANIES INC. (CA) 2003-05-08 — — US disclosed
US-20030083649-A1 Method for reducing or preventing PDT related inflammation VALEANT SP. Z.O.O. (PL) 2003-05-01 — — US disclosed
WO-2003028628-A2 PHOTOSENSITIZING CARBAMATE DERIVATIVES MIRAVANT PHARMACEUTICALS, INC. (US) 2003-04-10 — — WO disclosed
US-20020183302-A1 Method to prevent vision loss TECHNOLAS PERFECT VISION GMBH (DE) 2002-12-05 — — US disclosed
US-20020173832-A1 Reduced fluence rate PDT TECHNOLAS PERFECT VISION GMBH (DE) 2002-11-21 — — US disclosed
US-20020156062-A1 Drug delivery system for hydrophobic drugs BAUSCH HEALTH COMPANIES INC. (CA) 2002-10-24 — — US disclosed
US-20020155089-A1 Drug delivery systems for photodynamic therapy UNIVERSITY OF BRITISH COLUMBIA, THE (CA) 2002-10-24 — — US disclosed
US-20020061330-A1 Supports for photosensitizer formulations BRITISH COLUMBIA, THE UNIVERSITY OF (CA) 2002-05-23 — — US disclosed
US-20020022032-A1 Immuno-adjuvant PDT treatment of metastatic tumors QLT INC. (CA) 2002-02-21 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030099596-A1 Treatment of macular edema VEGFA, PPOX, FLT4 ABL1 2178/4885ABCB1 1857/4885BCR 3063/4885
US-20020183302-A1 Method to prevent vision loss VEGFA, ALDH1A2, PDE6C ABL1 3219/4885ABCB1 3638/4885BCR 3156/4885
US-10632096-B2 Method of quenching singlet and triplet excited states of photodegradable pigments, such as porphyrin compounds, particularly protoporphyrin IX, with conjugated fused tricyclic compounds having electron withdrawing groups, to reduce generation of singlet oxygen CBR3, NOX3, CCND3 ABL1 1627/4885ABCB1 2268/4885BCR 1496/4885
US-20020156062-A1 Drug delivery system for hydrophobic drugs LIPA, MLEC, ABCG2 ABL1 4487/4885ABCB1 35/4885BCR 498/4885
US-20020155089-A1 Drug delivery systems for photodynamic therapy PIN1, PPOX, DHFR ABL1 515/4885ABCB1 19/4885BCR 697/4885
US-20020061330-A1 Supports for photosensitizer formulations PPOX, PPIF, SDHA ABL1 1674/4885ABCB1 273/4885BCR 4593/4885
US-20020022032-A1 Immuno-adjuvant PDT treatment of metastatic tumors CD74, ANXA11, ANXA1 ABL1 3420/4885ABCB1 1288/4885BCR 2676/4885
US-20030087889-A1 Photodynamic therapy of occult age-related macular degeneration ALDH1A2, AGER, CRY2 ABL1 3354/4885ABCB1 3488/4885BCR 3335/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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