SCHEMBL1338705

SCHEMBL1338705

Cn1c(=O)c(-c2ccc(Cl)cc2Cl)cc2c3cc(-c4ccnn4CCO)ccc3n(C)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 3/20 0.42
▸ CNR1 P21554 12/20 0.38
▸ CNR2 P34972 12/20 0.38
▸ MAPK8 P45983 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ EGFR P00533 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ ADRA2C P18825 1/20 0.36
▸ MAPK3 P27361 1/20 0.36
▸ OPRL1 P41146 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ SLC18A2 Q05940 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ TMEM97 Q5BJF2 1/20 0.36

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
SCHEMBL1339397 0.91 MARS1 (0.39) MARS1CNR1CNR2KDM4EALDH1A1
SCHEMBL1336974 0.89 CNR1 (0.38) CNR1CNR2MAPK8KDM4EALDH1A1
SCHEMBL1340416 0.88 ALDH1A1 (0.39) CNR1CNR2KDM4EALDH1A1GAA
SCHEMBL1337038 0.83 MARS1 (0.39) MARS1CNR1CNR2MAPK8KDM4E
SCHEMBL1336927 0.82 PIK3CD (0.36) CNR1CNR2KDM4EALDH1A1GAA
SCHEMBL1339707 0.82 MARS1 (0.47) MARS1CNR1CNR2MAPK8EGFR
SCHEMBL1339158 0.80 MARS1 (0.36) MARS1CNR1CNR2KDM4EALDH1A1
SCHEMBL1339131 0.79 NOTUM (0.39) CNR1CNR2KDM4EALDH1A1GAA
SCHEMBL1339478 0.78 CNR1 (0.39) CNR1CNR2KDM4EALDH1A1GAA
SCHEMBL1338386 0.78 NOTUM (0.45) CNR1CNR2KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063061-B2 6-(2-amino-1,3-thiazol-4-yl)-3-(2,4-dichlorophenyl)-1-methyl-1,9-dihydro-2H-pyrido[2,3-b]indol-2-one; affinity for GABAA-receptor-associated omega modulatory sites SANOFI-AVENTIS (FR) 2011-11-22 — — US disclosed
EP-1940840-B1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-07-21 — — EP disclosed
US-20080262020-A1 6-Heteroarylpyridoindolone Derivatives, Their Preparation and Therapeutic Use Thereof SANOFI-AVENTIS (FR) 2008-10-23 — — US disclosed
EP-1940840-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 — — EP disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 — — 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-20080262020-A1 6-Heteroarylpyridoindolone Derivatives, Their Preparation and Therapeutic Use Thereof CYP11B2, CYP11B1, CYP2D6 MARS1 2786/4885CNR1 262/4885CNR2 299/4885

“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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