SCHEMBL3411986

SCHEMBL3411986

Cc1ccc(C(=O)Nc2ccccc2)c(C)c1C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.66
ALDH1A1 P00352 1/20 0.55
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
TP53 P04637 1/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
MAPT P10636 1/20 0.53
CASP3 P42574 1/20 0.53
RAB9A P51151 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
TDP1 Q9NUW8 3/20 0.51
CYP1A2 P05177 1/20 0.51
METAP2 P50579 1/20 0.50

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
SCHEMBL4138863 0.86 HPGD (0.77) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL21993 0.79 HPGD (1.00) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL4147334 0.77 GPR27 (0.72) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL14112955 0.77 HPGD (0.69) HPGDALDH1A1MEN1KMT2ALMNA
Iodomethane SCHEMBL20530190 0.76 HPGD (0.93) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL29177155 0.76 HPGD (0.68) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL437231 0.76 ALDH1A1 (0.87) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL18190481 0.76 MEN1 (0.72) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL7757783 0.75 HDAC6 (0.44) KDM4ELMNAHSD17B10SMN1; SMN2
SCHEMBL2169634 0.75 MEN1 (0.68) HPGDALDH1A1MEN1KMT2AKDM4E

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
EP-2197850-A1 DERIVATIVES OF N-PHENYLACETAMIDE, INHIBITORS OF THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM Galderma Research & Development (FR) 2010-06-23 EP disclosed
WO-2009030747-A1 DERIVATIVES OF N-PHENYLACETAMIDE, INHIBITORS OF THE ENZYME SOAT-1, AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-03-12 WO disclosed