SCHEMBL1653180

SCHEMBL1653180

C=CCc1ccc(CBr)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.52
▸ CYP3A4 P08684 3/20 0.52
▸ TSHR P16473 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ XDH P47989 1/20 0.46
▸ GABRA1 P14867 4/20 0.45
▸ GABRB2 P47870 4/20 0.45
▸ CNR2 P34972 4/20 0.45
▸ MAPT P10636 3/20 0.45
▸ PPARG P37231 2/20 0.45
▸ PPARD Q03181 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ CNR1 P21554 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH2 P05091 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
SCHEMBL8082725 0.93 ALDH1A1 (0.47) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
SCHEMBL3526348 0.89 ALDH1A1 (0.44) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
SCHEMBL173301 0.86 ALDH1A1 (0.64) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
Phosphine SCHEMBL28908227 0.83 ALDH1A1 (0.61) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
Bromide SCHEMBL8645583 0.83 ALDH1A1 (0.61) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
Water SCHEMBL29179560 0.83 ALDH1A1 (0.61) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
Hydrogen Peroxide SCHEMBL7816450 0.80 ALDH1A1 (0.58) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
Hydrogen Peroxide SCHEMBL5496256 0.80 ALDH1A1 (0.58) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
SCHEMBL6554880 0.80 ALDH1A1 (0.48) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53
SCHEMBL20391245 0.79 ALDH1A1 (0.42) ALDH1A1CYP3A4TSHRSMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106456701-B Modulation of complement activity RA制药公司 2020-01-07 — — CN claimed
CN-106456701-A Modulation of complement activity RA制药公司 2017-02-22 — — CN claimed
EP-0422040-A4 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES — 1991-08-07 — — EP claimed
EP-0422040-A1 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES DUNLENA PTY. LIMITED (AU) 1991-04-17 — — EP claimed
WO-1989012041-A1 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES DUNLENA PTY. LIMITED (AU) 1989-12-14 — — WO claimed
JP-3141237-A — — None — — JP disclosed
US-20240182526-A1 COMPOSITIONS AND METHODS FOR MODULTING INFLAMMATORY AND DEGENERATIVE DISORDER UNIV SOUTHERN CALIFORNIA (US) 2024-06-06 — — US disclosed
US-20240156896-A1 Modulators of Complement Activity UCB HOLDINGS, INC. 2024-05-16 — — US disclosed
US-11965040-B2 Modulation of complement activity RA PHARMACEUTICALS, INC. (US) 2024-04-23 — — US disclosed
US-20240052109-A1 POLYSILOXANE VINYLIC MONOMERS AND USES THEREOF ALCON INC. (CH) 2024-02-15 — — US disclosed
US-20240024520-A1 AUTONOMOUS KNOB DOMAIN PEPTIDES UCB Biopharma SRL (BE) 2024-01-25 — — US disclosed
US-20230265235-A1 CURABLE POLYFARNESENE-BASED COMPOSITIONS FINA TECHNOLOGY, INC. (US) 2023-08-24 — — US disclosed
JP-H03141237-A FLUORINE-CONTAINING TRICYCLIC COMPOUND HAVING OXYMETHYLENE BOND DAINIPPON INK & CHEM INC 1991-06-17 — — JP disclosed
EP-0431173-A1 CURING AGENT, METHOD OF PREPARATION THEREOF, AND CURABLE COMPOSITION PREPARED THEREFROM Kanegafuchi Chemical Industry Co., Ltd. (JP) 1991-06-12 — — EP disclosed
US-5019576-A Anticoagulants SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1991-05-28 — — US disclosed
EP-0415404-A2 Process for producing unsaturated group-terminated high-molecular weight polyalkylene oxide KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-03-06 — — EP disclosed
EP-0312967-A1 Sealant for double-layered glass KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-04-26 — — EP disclosed
US-4411912-A Insecticidal isovaleric acid esters ZOECON CORPORATION (US) 1983-10-25 — — US disclosed
US-4243819-A Substituted amino acids ZOECON CORPORATION (US) 1981-01-06 — — US disclosed
US-3971751-A ROOM TEMPERATURE KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JA) 1976-07-27 — — 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 (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-20240156896-A1 Modulators of Complement Activity C3AR1, C1QBP, C5AR1 ALDH1A1 4679/4885CYP3A4 4400/4885TSHR 551/4885
US-11965040-B2 Modulation of complement activity C5, C3AR1, CFH ALDH1A1 3629/4885CYP3A4 3653/4885TSHR 1539/4885
US-20240182526-A1 COMPOSITIONS AND METHODS FOR MODULTING INFLAMMATORY AND DEGENERATIVE DISORDER TNF, AGER, GRN ALDH1A1 3176/4885CYP3A4 4869/4885TSHR 3072/4885

“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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