SCHEMBL1338699

SCHEMBL1338699

Cn1c(=O)c(-c2ccc(Br)cc2)cc2c3cc(-c4nc(CNC(=O)C(C)(C)C)cs4)ccc3n(C)c21

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 13/20 0.38
▸ TRPA1 O75762 1/20 0.34
▸ TRPV4 Q9HBA0 1/20 0.34
▸ PTGES O14684 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ SREBF2 Q12772 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
SCHEMBL1338038 0.84 LMNA (0.41) ENPP2SREBF2
SCHEMBL1339064 0.84 SREBF2 (0.38) ENPP2HDAC1HDAC8HDAC6SREBF2
SCHEMBL1339356 0.78 LMNA (0.43) ENPP2SREBF2
SCHEMBL1339172 0.74 LMNA (0.40) ENPP2SREBF2
SCHEMBL1338217 0.72 SHMT1 (0.40) ENPP2
SCHEMBL1338328 0.72 LMNA (0.39) TRPA1TRPV4HDAC1HDAC8HDAC6
SCHEMBL1339424 0.71 SHMT1 (0.47) —
SCHEMBL3135467 0.71 KMT2A (0.39) —
SCHEMBL1339391 0.70 PARP1 (0.48) ENPP2TRPA1TRPV4HDAC1HDAC8
SCHEMBL1338828 0.70 RAB9A (0.45) —

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 3 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

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 ENPP2 891/4885TRPA1 4679/4885TRPV4 4630/4885

“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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