SCHEMBL7430600

SCHEMBL7430600

CSc1sc(C(=O)N2CCN(C)CC2)c2c1C(=O)/C(=C/O)C(C)(C)C2

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.34
PTPN7 P35236 1/20 0.34
DUSP3 P51452 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
CDK19 Q9BWU1 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
PARP1 P09874 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7430603 1.00 NPSR1 (0.38) NPSR1LMNAMAPK1PTPN7DUSP3
SCHEMBL7442946 0.91 NPSR1 (0.39) NPSR1LMNAALDH1A1KDM4EPOLB
SCHEMBL7442942 0.91 NPSR1 (0.39) NPSR1LMNAALDH1A1KDM4EPOLB
SCHEMBL7441294 0.90 NPSR1 (0.39) NPSR1LMNAALDH1A1KDM4EPOLB
SCHEMBL7437153 0.88 LMNA (0.38) NPSR1LMNASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL7437156 0.88 LMNA (0.38) NPSR1LMNASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL7440274 0.80 HPGD (0.33) LMNAALDH1A1
SCHEMBL7437284 0.80 LMNA (0.33) NPSR1LMNA
SCHEMBL7440268 0.80 HPGD (0.33) LMNAALDH1A1
SCHEMBL7437761 0.80 CCNC (0.43) NPSR1LMNAALDH1A1KDM4EPOLB

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-6143773-A Substituted thienobenzisoxazole derivatives for enhancing cognition MERCK SHARP & DOHME LIMITED (GB) 2000-11-07 US disclosed