SCHEMBL396614

SCHEMBL396614

COc1cc(OC)c2ccccc2n1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.64
▸ LMNA P02545 3/20 0.64
▸ SMN1; SMN2 Q16637 3/20 0.64
▸ KDM4E B2RXH2 5/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ ALOX15 P16050 1/20 0.60
▸ MAPT P10636 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ POLB P06746 3/20 0.52
▸ NQO2 P16083 2/20 0.52
▸ SLC2A1 P11166 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ RAD52 P43351 1/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ ACACA Q13085 1/20 0.46
▸ PDPK1 O15530 1/20 0.45
▸ ADORA2A P29274 1/20 0.45

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
SCHEMBL30065410 1.00 HPGD (0.64) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL28611035 0.98 HPGD (0.62) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL3964960 0.87 HPGD (0.51) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL7700056 0.83 ALDH1A1 (0.55) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8063146 0.83 ALOX15 (0.63) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL1810765 0.83 SMN1; SMN2 (0.62) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL27701421 0.82 ALOX15 (0.61) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL7694112 0.81 KDM4E (0.54) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL29877118 0.81 LMNA (0.64) HPGDLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL266444 0.81 LMNA (0.64) HPGDLMNASMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113201028-B Methoxy-regulation-based broadband yellow phosphorescent 2-phenylquinoline iridium (III) complex and preparation method and application thereof 南京邮电大学 2022-12-09 — — CN claimed
CN-113201028-A Methoxy-regulation-based broadband yellow phosphorescent 2-phenylquinoline iridium (III) complex and preparation method and application thereof 南京邮电大学 2021-08-03 — — CN claimed
CN-113201028-B Methoxy-regulation-based broadband yellow phosphorescent 2-phenylquinoline iridium (III) complex and preparation method and application thereof 南京邮电大学 2022-12-09 — — CN disclosed
CN-113201028-A Methoxy-regulation-based broadband yellow phosphorescent 2-phenylquinoline iridium (III) complex and preparation method and application thereof 南京邮电大学 2021-08-03 — — CN disclosed
CN-112939857-A Synthetic method of alkylated quinoline compound 中国科学院大连化学物理研究所 2021-06-11 — — CN disclosed
CN-107501099-B Modulators of ATP-binding cassette transporters 沃泰克斯药物股份有限公司 2021-03-19 — — CN disclosed
EP-3705477-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS Vertex Pharmaceuticals Incorporated (US) 2020-09-09 — — EP disclosed
US-10662192-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-05-26 — — US disclosed
US-10662192-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-05-26 — — US disclosed
EP-3216787-B1 INTERMEDIATES FOR THE PREPARATION OF MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMA (US) 2020-02-19 — — EP disclosed
EP-3216787-B1 INTERMEDIATES FOR THE PREPARATION OF MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMA (US) 2020-02-19 — — EP disclosed
US-20080071095-A1 Cystic fibrosis transmembrane conductance VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-03-20 — — US disclosed
WO-2007075946-A1 COMPOUNDS USEFUL IN CFTR ASSAYS AND METHODS THEREWITH VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-07-05 — — WO disclosed
EP-1773816-A2 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS Vertex Pharmaceuticals Incorporated (US) 2007-04-18 — — EP disclosed
US-20060074075-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"), used for treating genetic disorders; respiratory system disorders VERTEX PHARMACEUTICALS INCORPORATED 2006-04-06 — — US disclosed
WO-2006002421-A2 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2006-01-05 — — WO disclosed
WO-2002026713-A1 ANTIPARASITIC COMPOUNDS KING'S COLLEGE LONDON (GB) 2002-04-04 — — WO disclosed
EP-0317188-B1 Heteroaromatic enamide derivatives and their use as pesticides ROUSSEL UCLAF (FR) 1995-09-27 — — EP disclosed
US-5114940-A Insecticides or anthelmintics from fused ring heterocycles containing amides or thioamides ROUSSEL-UCLAF (FR) 1992-05-19 — — US disclosed
EP-0317188-A2 Heteroaromatic enamide derivatives and their use as pesticides ROUSSEL UCLAF (FR) 1989-05-24 — — EP 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 (3 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-10662192-B2 Modulators of ATP-binding cassette transporters CFTR, ABCB1, ABCC2 HPGD 1121/4885LMNA 2816/4885SMN1; SMN2 4837/4885
US-20080071095-A1 Cystic fibrosis transmembrane conductance CFTR, ABCB1, ABCC1 HPGD 1487/4885LMNA 3399/4885SMN1; SMN2 4860/4885
US-20060074075-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"), used for treating genetic disorders; respiratory system disorders CFTR, ABCC4, ABCC2 HPGD 1132/4885LMNA 3499/4885SMN1; SMN2 4740/4885

“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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