SCHEMBL11680944

SCHEMBL11680944

NN(C(=O)CCCCC(=O)N(N)C(=O)Cc1ccccc1)C(=O)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.49
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
AKR1B1 P15121 1/20 0.47
REN P00797 2/20 0.44
KDM4A O75164 1/20 0.44
KDM5A P29375 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
PHF8 Q9UPP1 1/20 0.44
KDM2A Q9Y2K7 1/20 0.44
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
PAM P19021 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL27470447 0.90 MEN1 (0.48) ALOX5CES2CES1MEN1KMT2A
SCHEMBL11321849 0.82 CES1 (0.52) ALOX5CES2CES1AKR1B1REN
SCHEMBL8458100 0.81 NPC1 (0.51) ALOX5CES2CES1AKR1B1REN
SCHEMBL9061013 0.79 CES2 (0.48) ALOX5CES2CES1AKR1B1REN
SCHEMBL9730640 0.77 MCL1 (0.46) ALOX5CES2CES1AKR1B1REN
SCHEMBL29291237 0.76 CES1 (0.54) ALOX5CES2CES1AKR1B1REN
SCHEMBL8711613 0.76 ALOX5 (0.47) ALOX5CES2CES1AKR1B1PAM
SCHEMBL9000284 0.76 HSD17B3 (0.50) MEN1KMT2A
SCHEMBL815273 0.76 L3MBTL1 (0.48) ALOX5CES2CES1MAPT
SCHEMBL4430452 0.75 CES2 (0.52) ALOX5CES2CES1AKR1B1REN

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-4038247-A STABILIZING POLYOLEFINS WITH DIACYL DIHYDRAZIDES CIBA-GEIGY CORPORATION (US) 1977-07-26 US disclosed
US-4002680-A Process for the manufacture of acylhydrazines CIBA-GEIGY CORPORATION (US) 1977-01-11 US disclosed