SCHEMBL7101191

SCHEMBL7101191

CC(C)(C)c1ccc(OC(S)C(N)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
NR1H4 Q96RI1 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
MAPT P10636 4/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PRSS1 P07477 1/20 0.42
ACR P10323 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL19251354 0.81 NR1H4 (0.48) SMN1; SMN2NR1H4CA1CA2CA9
SCHEMBL2007632 0.76 PARP10 (0.42) MAPTTDP1L3MBTL1ALDH1A1ALOX15
SCHEMBL9866417 0.76 SMN1; SMN2 (0.45) SMN1; SMN2NR1H4CA1CA2CA9
SCHEMBL14076366 0.73 LDHA (0.58) SMN1; SMN2NR1H4CA1CA2CA9
SCHEMBL27468878 0.72 KIF11 (0.59) SMN1; SMN2CA1CA2CA9MAPT
SCHEMBL5273528 0.71 CYP1A2 (0.61) SMN1; SMN2NR1H4MAPTTDP1L3MBTL1
SCHEMBL4343686 0.71 CYP1A2 (0.61) SMN1; SMN2NR1H4MAPTTDP1L3MBTL1
SCHEMBL5272169 0.71 CYP1A2 (0.61) SMN1; SMN2NR1H4MAPTTDP1L3MBTL1
SCHEMBL18287880 0.71 MAPT (0.47) SMN1; SMN2NR1H4CA1CA2CA9
SCHEMBL11716060 0.70 SMN1; SMN2 (0.50) SMN1; SMN2NR1H4MAPTTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1230230-B1 INDENO-DIHYDROTHIAZOLE DERIVATIVES, THE PRODUCTION THEREOF AND THEIR USE AS ANORECTIC MEDICAMENTS AVENTIS PHARMA GMBH (DE) 2003-09-17 EP disclosed
EP-1230230-A1 INDENO-, NAPHTHO-, AND BENZOCYCLOHEPTA-DIHYDROTHIAZOLE DERIVATIVES, THE PRODUCTION THEREOF AND THEIR USE AS ANORECTIC MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2002-08-14 EP disclosed
US-6387935-B1 ANOREXIGENIC AGENT AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-05-14 US disclosed
WO-2001032638-A1 INDENO-, NAPHTHO-, AND BENZOCYCLOHEPTA-DIHYDROTHIAZOLE DERIVATIVES, THE PRODUCTION THEREOF AND THEIR USE AS ANORECTIC MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-05-10 WO disclosed