SCHEMBL1339434

SCHEMBL1339434

Cn1c(=O)c(-c2ccc(Cl)cc2Cl)cc2c3cc(-c4cc(CN5CCCCC5)n[nH]4)ccc3n(C)c21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 4/20 0.36
▸ CNR2 P34972 2/20 0.36
▸ MCHR1 Q99705 3/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ ALPL P05186 5/20 0.35
▸ NPY1R P25929 1/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ CTSS P25774 1/20 0.34
▸ SIGMAR1 Q99720 1/20 0.33
▸ OPRL1 P41146 1/20 0.33
▸ TACR1 P25103 1/20 0.33

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
SCHEMBL1338782 0.86 CNR1 (0.37) CNR1CNR2ALPLSIGMAR1OPRL1
SCHEMBL1338161 0.85 CNR1 (0.35) CNR1CNR2CYP3A4CYP2C19ALPL
SCHEMBL1339414 0.83 GABRG2 (0.43) CNR1CNR2
SCHEMBL1338262 0.83 ENPP2 (0.46) —
SCHEMBL1336848 0.82 CNR1 (0.38) CNR1CNR2SIGMAR1OPRL1
SCHEMBL1339276 0.82 MKNK1 (0.43) CNR1CNR2SIGMAR1OPRL1
Hydrochloric Acid SCHEMBL1338816 0.81 MCHR1 (0.37) CNR1CNR2MCHR1CYP3A4CYP2C19
SCHEMBL3139962 0.81 MCHR1 (0.37) CNR1CNR2MCHR1CYP3A4CYP2C19
SCHEMBL1336811 0.80 P2RX3 (0.32) CNR1CNR2OPRL1
SCHEMBL1337456 0.79 MARS1 (0.38) CNR1CNR2ALPLSIGMAR1OPRL1

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 CNR1 262/4885CNR2 299/4885MCHR1 2856/4885

“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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