SCHEMBL7437153

SCHEMBL7437153

CSc1sc(C(=O)N2CCOCC2)c2c1C(=O)/C(=C/O)C(C)(C)C2

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 9/20 0.35
POLB P06746 3/20 0.35
HSD17B10 Q99714 5/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR1 P21554 1/20 0.34
ALOX15 P16050 3/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 3/20 0.33
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
HTT P42858 1/20 0.30
GAA P10253 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
SCHEMBL7437156 1.00 LMNA (0.38) LMNANPSR1ALDH1A1POLBHSD17B10
SCHEMBL7442946 0.90 NPSR1 (0.39) LMNANPSR1ALDH1A1POLBHPGD
SCHEMBL7430600 0.88 NPSR1 (0.38) LMNANPSR1ALDH1A1POLBHSD17B10
SCHEMBL7416886 0.79 NPSR1 (0.57) LMNANPSR1ALDH1A1POLBHSD17B10
SCHEMBL7437284 0.79 LMNA (0.33) LMNANPSR1
SCHEMBL7437761 0.79 CCNC (0.43) LMNANPSR1ALDH1A1POLBKDM4E
SCHEMBL7437764 0.79 CCNC (0.43) LMNANPSR1ALDH1A1POLBKDM4E
SCHEMBL7429710 0.78 HPGD (0.32) LMNANPSR1ALDH1A1HPGD
SCHEMBL7446073 0.76 ALDH1A1 (0.33) LMNANPSR1ALDH1A1POLBHSD17B10
SCHEMBL7443342 0.76 CCNC (0.45) LMNANPSR1ALDH1A1HSD17B10CNR1

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