SCHEMBL5810239

SCHEMBL5810239

OCc1ccc2[nH]c3ccccc3c2c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.57
ALDH1A1 P00352 9/20 0.56
HSD17B10 Q99714 4/20 0.54
GPR3 P46089 1/20 0.54
KIF11 P52732 6/20 0.53
KDM4E B2RXH2 8/20 0.50
HPGD P15428 5/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
MAPT P10636 3/20 0.50
HCRTR1 O43613 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46

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
SCHEMBL28335170 0.90 ALDH1A1 (0.59) AHRALDH1A1HSD17B10KIF11KDM4E
SCHEMBL29844524 0.90 ALDH1A1 (0.59) AHRALDH1A1HSD17B10KIF11KDM4E
SCHEMBL2311195 0.85 AHR (0.53) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL19768708 0.82 AHR (0.59) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL1734811 0.81 AHR (0.57) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL30196772 0.81 AHR (0.57) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL27835129 0.81 AHR (0.57) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL4812375 0.81 KIF11 (0.79) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL22089502 0.81 AHR (0.57) AHRALDH1A1HSD17B10GPR3KIF11
SCHEMBL6615916 0.80 KDM4E (0.54) AHRALDH1A1HSD17B10GPR3KIF11

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106543147-B A kind of substituted carbazole-imidazole salts or benzimidazole salt compound and preparation method thereof 云南大学 2019-07-19 CN disclosed
US-8772311-B2 Harmine derivatives, intermediates used in their preparations, preparation processes and use thereof XINJIANG HUASHIDAN PHARMACEUTICAL RESEARCH CO., LTD. (CN) 2014-07-08 US disclosed
US-8772311-B2 Harmine derivatives, intermediates used in their preparations, preparation processes and use thereof XINJIANG HUASHIDAN PHARMACEUTICAL RESEARCH CO., LTD. (CN) 2014-07-08 US disclosed
US-20090227619-A1 Harmine derivatives, intermediates used in their preparations, preparation processes and use therefo XINJIANG HUASHIDAN PHARMACEUTICAL RESEARCH CO., LTD. (CN) 2009-09-10 US disclosed
US-20090227619-A1 Harmine derivatives, intermediates used in their preparations, preparation processes and use therefo XINJIANG HUASHIDAN PHARMACEUTICAL RESEARCH CO., LTD. (CN) 2009-09-10 US disclosed
WO-2006012310-A2 CARBAZOLE DERIVATIVES FOR TREATING POLYCYSTIC KIDNEY DISEASE GENZYME CORPORATION (US) 2006-02-02 WO 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 (1 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-20090227619-A1 Harmine derivatives, intermediates used in their preparations, preparation processes and use therefo TPH1, HTR1F, TPH2 AHR 366/4885ALDH1A1 324/4885HSD17B10 1360/4885

“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.