SCHEMBL9500403

SCHEMBL9500403

CCc1ccc(C(=O)OC(CC)c2ccc(C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.53
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
FFAR1 O14842 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
PLK1 P53350 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL9498545 0.87 ALDH1A1 (0.54) UTS2RALDH1A1TDP1MEN1KMT2A
SCHEMBL9500077 0.86 ALDH1A1 (0.55) UTS2RALDH1A1POLBMEN1KMT2A
SCHEMBL9499271 0.86 NPSR1 (0.53) UTS2RALDH1A1TDP1POLBMEN1
SCHEMBL9500258 0.84 CYP2A6 (0.53) UTS2RALDH1A1TDP1POLBMEN1
SCHEMBL22416005 0.82 PDCD1 (0.53) UTS2RALDH1A1POLBMEN1KMT2A
SCHEMBL9498981 0.82 PDCD1 (0.53) UTS2RALDH1A1POLBMEN1KMT2A
SCHEMBL803259 0.82 PDCD1 (0.53) UTS2RALDH1A1POLBMEN1KMT2A
SCHEMBL9502047 0.82 RARB (0.53) UTS2RALDH1A1MEN1KMT2AMAPT
SCHEMBL9501806 0.82 THRA (0.49) ALDH1A1TDP1MEN1KMT2AMAPT
SCHEMBL9499364 0.81 L3MBTL1 (0.39) UTS2RALDH1A1TDP1POLBCYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0354655-B1 1-PHENYL-1-PROPANOL DERIVATIVES CHISSO CORPORATION (JP) 1993-04-07 EP disclosed
US-5076947-A Optically active; free from temperature dependence CHISSO CORPORATION (JP) 1991-12-31 US disclosed
EP-0354655-A2 1-Phenyl-1-propanol derivatives CHISSO CORPORATION (JP) 1990-02-14 EP disclosed