SCHEMBL1339518

SCHEMBL1339518

Cn1c(=O)c(-c2ccc(Cl)cc2Cl)cc2c3cc(-c4csc(CNC(=O)OCc5ccccc5)n4)ccc3n(C)c21

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.48
▸ ADORA2A P29274 1/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ CNR1 P21554 8/20 0.37
▸ ENPP2 Q13822 2/20 0.36
▸ KAT2B Q92831 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ EIF4E P06730 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ TNKS O95271 1/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.34
▸ HPSE Q9Y251 1/20 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
SCHEMBL1339391 0.87 PARP1 (0.48) PARP1ADORA2AADORA2BENPP2KAT2B
SCHEMBL1338539 0.82 L3MBTL1 (0.37) CNR1EIF4ECNR2HPSE
SCHEMBL1339161 0.82 EIF4E (0.39) CNR1EGFREIF4ECNR2HPSE
SCHEMBL1336992 0.82 RAB9A (0.55) PARP1CNR1MAPTEIF4ECNR2
SCHEMBL1337288 0.81 GABRA1 (0.41) CNR1MAPTEIF4ECNR2HPSE
SCHEMBL1339436 0.81 EIF4E (0.38) CNR1EGFREIF4ECNR2HPSE
SCHEMBL1339348 0.81 PARP1 (0.43) PARP1CNR1EGFREIF4ECNR2
SCHEMBL1338157 0.81 NPC1 (0.40) PARP1CNR1MAPTEIF4ECNR2
SCHEMBL1339047 0.80 EIF4E (0.37) CNR1EGFREIF4ECNR2HPSE
SCHEMBL1338822 0.80 PARP1 (0.37) PARP1CNR1EGFREIF4ECNR2

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 PARP1 370/4885ADORA2A 278/4885ADORA2B 318/4885

“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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