SCHEMBL4966957

SCHEMBL4966957

Cc1ccc(-n2c3c(c4cc(Cl)ccc42)CCCC3N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.45
▸ MAPT P10636 5/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ GAA P10253 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ HSD17B10 Q99714 7/20 0.42
▸ USP2 O75604 1/20 0.42
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ TEAD4 Q15561 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40

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
SCHEMBL4972027 0.92 MAPT (0.46) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4972329 0.88 KDM4E (0.42) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4968337 0.88 MAPT (0.44) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4970200 0.87 MAPT (0.43) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4971672 0.83 HTR6 (0.43) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4969062 0.82 KDM4E (0.43) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4970261 0.80 KDM4E (0.42) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4968166 0.79 KDM4E (0.40) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4970757 0.78 KDM4E (0.41) KDM4EMAPTALDH1A1GAALMNA
SCHEMBL4971454 0.74 HTR6 (0.41) KDM4EMAPTALDH1A1GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1654228-B1 TETRAHYDROCARBAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2008-10-22 — — EP claimed
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