SCHEMBL7919231

SCHEMBL7919231

N#CCC(=O)N(Cc1ccccc1)C(=O)NCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.59
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.43
POLB P06746 1/20 0.43
CTSL P07711 2/20 0.42
CTSS P25774 2/20 0.42
PLIN1 O60240 1/20 0.42
LMNA P02545 1/20 0.42
PLIN5 Q00G26 1/20 0.42
ABHD5 Q8WTS1 1/20 0.42
MAPK14 Q16539 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRL1 P41146 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL27807993 0.82 GAA (0.45) MCL1GAAHPGDLMNANPC1
SCHEMBL4793277 0.81 GAA (0.50) MCL1GAAHPGDLMNAOPRM1
SCHEMBL7919195 0.80 MCL1 (0.40) MCL1POLBCTSLCTSSLMNA
SCHEMBL7909507 0.80 MCL1 (0.49) MCL1GAAHPGDPOLBCTSL
SCHEMBL8175414 0.78 POLB (0.50) GAAPOLBLMNANPC1RAB9A
SCHEMBL7421662 0.78 ALDH1A1 (0.51) GAAPOLBLMNANPC1RAB9A
SCHEMBL8366340 0.77 TP53 (0.50) GAAHPGDLMNAOPRM1OPRL1
SCHEMBL6184360 0.76 CTSS (0.56) MCL1POLBCTSLCTSSLMNA
SCHEMBL654148 0.75 MCL1 (1.00) MCL1GAAHPGDLMNARAB9A
SCHEMBL8749389 0.75 POLB (0.51) MCL1POLBCTSLCTSSLMNA

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-6211270-B1 HEAT AND LIGHT STABILIZERS FOR POLYMERS WITCO VINYL ADDITIVES GMBH (DE) 2001-04-03 US disclosed