SCHEMBL11571012

SCHEMBL11571012

COCCC(=O)N(c1ccccc1)C1CC(OC)CC1N(C)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTB4R2 Q9NPC1 1/20 0.41
▸ SLC18A3 Q16572 1/20 0.38
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ CHRM2 P08172 3/20 0.36
▸ CHRM3 P20309 3/20 0.36
▸ CHRM1 P11229 2/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ OPRM1 P35372 3/20 0.35
▸ OPRD1 P41143 2/20 0.35
▸ OPRK1 P41145 2/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ REN P00797 1/20 0.35
▸ ALOX5 P09917 1/20 0.34
▸ CTSD P07339 1/20 0.34

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
SCHEMBL11330424 0.94 SLC18A3 (0.43) LTB4R2SLC18A3NPC1RAB9ACHRM2
SCHEMBL11454736 0.88 LTB4R2 (0.38) LTB4R2NPC1RAB9ACHRM2CHRM3
SCHEMBL11572452 0.86 LTB4R2 (0.34) LTB4R2NPC1RAB9AKMT2ATSHR
SCHEMBL11341302 0.83 ALDH1A1 (0.38) LTB4R2NPC1RAB9ACHRM2CHRM3
SCHEMBL11346998 0.82 KDM4E (0.34) LTB4R2SLC18A3NPC1RAB9AKMT2A
SCHEMBL11571013 0.80 SLC18A3 (0.44) SLC18A3CHRM2CHRM3CHRM1MAPK1
SCHEMBL11450445 0.78 TP53 (0.36) LTB4R2TSHROPRM1OPRD1OPRK1
SCHEMBL11569471 0.77 SLC18A3 (0.41) SLC18A3NPC1RAB9ACHRM2CHRM3
SCHEMBL11330427 0.77 SLC18A3 (0.46) SLC18A3CHRM2CHRM3MAPK1OPRM1
SCHEMBL11595372 0.76 SLC18A3 (0.50) SLC18A3CHRM2CHRM3CHRM1KMT2A

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
US-4159340-A N-(2-Aminocyclopentyl)-N-acylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
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