SCHEMBL9633241

SCHEMBL9633241

CON=C(C)c1ccc2ccccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
MAPT P10636 3/20 0.47
ALDH1A1 P00352 1/20 0.47
CASP3 P42574 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
GFER P55789 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
F2 P00734 1/20 0.44
PLG P00747 1/20 0.44
PLAU P00749 1/20 0.44
KLKB1 P03952 1/20 0.44

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
SCHEMBL11963960 0.81 CES2 (0.52) PPARGPPARACES2CES1MAPT
SCHEMBL10907716 0.81 CES2 (0.52) PPARGPPARACES2CES1MAPT
SCHEMBL8686485 0.80 PPARG (0.44) PPARGPPARACES2CES1MAPT
SCHEMBL11963974 0.80 RAB9A (0.65) PPARGPPARACES2CES1MAPT
SCHEMBL29510116 0.79 CASP3 (0.70) CES2CES1MAPTALDH1A1CASP3
SCHEMBL10041971 0.79 CASP3 (0.70) CES2CES1MAPTALDH1A1CASP3
SCHEMBL8485793 0.79 CASP3 (0.70) CES2CES1MAPTALDH1A1CASP3
SCHEMBL8306489 0.79 CASP3 (0.70) CES2CES1MAPTALDH1A1CASP3
SCHEMBL8304592 0.78 PPARG (0.58) PPARGPPARACES2CES1MAPT
SCHEMBL30098733 0.78 PPARG (0.46) PPARGPPARACES2CES1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145998-A Reduction of oxime or silyloxime SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-09-08 US disclosed
EP-0237305-B1 A METHOD FOR PRODUCING OPTICALLY ACTIVE AMINES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-03 EP disclosed