SCHEMBL8999280

SCHEMBL8999280

COC=C(C(=O)OC)c1ccccc1CSc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
PPARG P37231 6/20 0.43
PPARA Q07869 6/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL8999276 1.00 L3MBTL1 (0.44) L3MBTL1PPARGPPARANPC1RAB9A
SCHEMBL9701732 0.90 L3MBTL1 (0.41) L3MBTL1PPARGPPARANPC1RAB9A
SCHEMBL9655146 0.90 L3MBTL1 (0.41) L3MBTL1PPARGPPARANPC1RAB9A
SCHEMBL8999286 0.89 L3MBTL1 (0.46) L3MBTL1PPARGPPARANPC1RAB9A
SCHEMBL10335735 0.87 TDP1 (0.39) PPARGPPARAKMT2A
SCHEMBL9702194 0.87 PPARG (0.41) L3MBTL1PPARGPPARA
SCHEMBL9654222 0.87 PPARG (0.41) L3MBTL1PPARGPPARA
SCHEMBL9703363 0.87 ANPEP (0.41) PPARGPPARA
SCHEMBL9655702 0.87 ANPEP (0.41) PPARGPPARA
SCHEMBL10434819 0.82 ALDH1A1 (0.47) L3MBTL1RAB9ASMN1; SMN2KMT2A

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
US-5506263-A Benzyl derivatives and pesticides containing them BASF AKTIENGESELLSCHAFT (DE) 1996-04-09 US disclosed
EP-0582902-B1 Benzyl derivatives and pesticides containing them BASF AG (DE) 1995-11-29 EP disclosed
US-5416110-A Benzyl derivatives and pesticides containing them BASF AKTIENGESELLSCHAFT (DE) 1995-05-16 US disclosed
EP-0582902-A1 Benzyl derivatives and pesticides containing them BASF Aktiengesellschaft (DE) 1994-02-16 EP disclosed
US-4914128-A CONTROLLING PHYTOPATHOGENS BASF AKTIENGESELLSCHAFT (DE) 1990-04-03 US disclosed