SCHEMBL23675378

SCHEMBL23675378

CC(C)(C)OC(=O)N1CCC(NC(=O)c2cc(Cl)ccc2O)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.54
▸ CNR2 P34972 1/20 0.54
▸ MCHR1 Q99705 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ EPHX1 P07099 1/20 0.50
▸ STS P08842 2/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ ANO1 Q5XXA6 1/20 0.49
▸ LMNA P02545 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ CRHBP P24387 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ CRHR2 Q13324 1/20 0.48

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
SCHEMBL30100442 1.00 CNR1 (0.54) CNR1CNR2MCHR1POLBEPHX1
SCHEMBL31572401 0.88 EPHX2 (0.56) POLBEPHX1MAPTLMNAMEN1
SCHEMBL30100433 0.84 KDM4E (0.62) STSMAPTLMNAKDM4EMEN1
SCHEMBL23675376 0.84 KDM4E (0.62) STSMAPTLMNAKDM4EMEN1
SCHEMBL30100501 0.84 ALDH1A1 (0.52) CNR1CNR2ALDH1A1NPC1MAPT
SCHEMBL23675383 0.84 ALDH1A1 (0.52) CNR1CNR2ALDH1A1NPC1MAPT
SCHEMBL7532504 0.82 HDAC4 (0.60) CNR1CNR2EPHX1STSALDH1A1
SCHEMBL26098434 0.82 MCHR1 (0.56) MCHR1ALDH1A1NPC1MAPTMAPK1
SCHEMBL4716931 0.82 ALDH1A1 (0.57) CNR1CNR2EPHX1STSALDH1A1
SCHEMBL29268419 0.80 NPC1 (0.61) CNR1CNR2POLBEPHX1NPC1

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
WO-2021151104-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-07-29 — — WO disclosed
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