SCHEMBL9502184

SCHEMBL9502184

CCc1ccc(-c2ccc(C(O)CC)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
ATM Q13315 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PGR P06401 1/20 0.45
CYP17A1 P05093 1/20 0.45
EGFR P00533 1/20 0.41
FAAH O00519 1/20 0.40
PTGS2 P35354 1/20 0.39
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
ALDH1A1 P00352 2/20 0.38
TAOK1 Q7L7X3 1/20 0.38
TAOK3 Q9H2K8 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
UCHL1 P09936 1/20 0.37
S1PR1 P21453 1/20 0.37

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
SCHEMBL3917902 0.94 LMNA (0.60) LMNATSHRMAPK1ATMTDP1
SCHEMBL3917903 0.94 LMNA (0.60) LMNATSHRMAPK1ATMTDP1
SCHEMBL29861210 0.89 LMNA (0.65) LMNATSHRTDP1PGRCYP17A1
SCHEMBL9500269 0.84 LMNA (0.50) LMNAPGRLPLLIPGALDH1A1
SCHEMBL1607138 0.82 LMNA (0.75) LMNATSHRTDP1L3MBTL1PGR
SCHEMBL9498547 0.81 RARB (0.53) LMNATSHREGFRPTGS2ALDH1A1
SCHEMBL9498632 0.81 LMNA (0.56) LMNATDP1PGRCYP17A1FAAH
SCHEMBL13849288 0.81 ESR1 (0.56) LMNATSHRTDP1PGRCYP17A1
SCHEMBL25620711 0.81 MAPK1 (0.47) LMNATSHRMAPK1ATMTDP1
SCHEMBL12101296 0.81 TDP1 (0.47) LMNATSHRMAPK1ATMTDP1

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