SCHEMBL8420682

SCHEMBL8420682

CC(=O)N(C)c1ccc(-c2ccc(N(C)C(C)=O)c(C)c2)cc1C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FSCN1 Q16658 1/20 0.50
HSD17B1 P14061 9/20 0.40
HSD17B2 P37059 9/20 0.40
TSPO P30536 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MCL1 Q07820 1/20 0.37
RORC P51449 1/20 0.36
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
STS P08842 1/20 0.34
MAPT P10636 1/20 0.34
RXRB P28702 1/20 0.34
NPC1 O15118 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
SCHEMBL21390859 0.91 TSPO (0.44) FSCN1HSD17B1HSD17B2TSPOALDH1A1
SCHEMBL13043265 0.84 FSCN1 (0.50) FSCN1TSPOALDH1A1TDP1RAB9A
SCHEMBL913573 0.78 FSCN1 (0.34) FSCN1ALDH1A1
SCHEMBL14925281 0.78 KMT2A (0.46) FSCN1HSD17B1HSD17B2TSPOALDH1A1
SCHEMBL27513738 0.75 FSCN1 (0.42) FSCN1TSPOALDH1A1SMN1; SMN2
SCHEMBL29674730 0.75 TSPO (0.53) FSCN1HSD17B1HSD17B2TSPOALDH1A1
SCHEMBL5042970 0.75 TSPO (0.53) FSCN1HSD17B1HSD17B2TSPOALDH1A1
SCHEMBL6106055 0.74 FSCN1 (0.45) FSCN1HSD17B1HSD17B2TSPOALDH1A1
SCHEMBL913350 0.74 GSK3B (0.47) FSCN1ALDH1A1
SCHEMBL11503436 0.73 ALDH1A1 (0.44) HSD17B1HSD17B2ALDH1A1MCL1CYP3A4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0573573-B1 MESOGENIC GLYCIDYL AMINES DOW CHEMICAL CO (US) 1999-09-29 EP disclosed
US-5360884-A Coatings, adhesives, moldings, laminates and encapsulation THE DOW CHEMICAL COMPANY (US) 1994-11-01 US disclosed
EP-0573573-A1 MESOGENIC GLYCIDYL AMINES THE DOW CHEMICAL COMPANY (US) 1993-12-15 EP disclosed
US-5262509-A Curable coatings THE DOW CHEMICAL COMPANY (US) 1993-11-16 US disclosed
WO-1992015630-A2 MESOGENIC GLYCIDYL AMINES THE DOW CHEMICAL COMPANY (US) 1992-09-17 WO disclosed