SCHEMBL11670757

SCHEMBL11670757

CCN(c1ccccc1)C(C)OC(=O)Oc1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ OGG1 O15527 1/20 0.40
▸ TSHR P16473 1/20 0.38

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
SCHEMBL11670883 0.94 GHSR (0.41) GHSRKDM4EALDH1A1MAPTOGG1
SCHEMBL11671280 0.93 S1PR1 (0.42) GHSRKDM4EALDH1A1MAPTTSHR
SCHEMBL11670867 0.90 MTNR1B (0.43) —
SCHEMBL11670878 0.90 KMT2A (0.40) GHSRKDM4EALDH1A1MAPTOGG1
SCHEMBL11670388 0.89 KDM4E (0.42) GHSRKDM4EALDH1A1MAPTOPRM1
SCHEMBL11670254 0.87 LMNA (0.41) GHSRKDM4EALDH1A1MAPT
SCHEMBL11671701 0.87 TDP1 (0.42) KDM4EALDH1A1MAPTTSHR
SCHEMBL11672092 0.87 LMNA (0.45) ALDH1A1
SCHEMBL11670842 0.87 RXRA (0.44) —
SCHEMBL11671594 0.87 LMNA (0.44) KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
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