SCHEMBL9541373

SCHEMBL9541373

COC(=O)c1cccc(CN(C(=O)c2ccccc2)c2ccc(CC(C)C)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.52
▸ PTGES O14684 4/20 0.51
▸ ALOX5 P09917 4/20 0.51
▸ LOXL2 Q9Y4K0 1/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CETP P11597 1/20 0.46
▸ LTC4S Q16873 1/20 0.45
▸ CYP4F2 P78329 2/20 0.45
▸ CYP4A11 Q02928 2/20 0.45
▸ SENP1 Q9P0U3 1/20 0.44
▸ NR1H4 Q96RI1 2/20 0.44
▸ FOLH1 Q04609 1/20 0.44
▸ CASR P41180 1/20 0.44
▸ NR3C1 P04150 1/20 0.43
▸ PPARG P37231 1/20 0.42

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
SCHEMBL9541159 0.97 SLC7A5 (0.50) SLC7A5PTGESALOX5LOXL2RAB9A
SCHEMBL9368860 0.90 SLC7A5 (0.51) SLC7A5PTGESALOX5LOXL2RAB9A
SCHEMBL9372770 0.90 SLC7A5 (0.46) SLC7A5PTGESALOX5LOXL2RAB9A
SCHEMBL9368612 0.89 PTGES (0.52) PTGESALOX5RAB9ANPC1SMN1; SMN2
SCHEMBL9372874 0.89 PTGES (0.55) PTGESALOX5NPC1LTC4SNR1H4
SCHEMBL9538478 0.88 PTGES (0.53) PTGESALOX5RAB9ANPC1LTC4S
SCHEMBL9372894 0.86 PTGES (0.55) PTGESALOX5RAB9ANPC1LTC4S
SCHEMBL9369673 0.84 SLC7A5 (0.44) SLC7A5LOXL2RAB9AKDM4EALDH1A1
SCHEMBL9369194 0.82 NPC1 (0.49) SLC7A5PTGESALOX5RAB9ANPC1
SCHEMBL9368458 0.81 PTGES (0.45) PTGESALOX5RAB9ANPC1MAPT

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-1993003012-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-18 — — WO disclosed
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