SCHEMBL9499159

SCHEMBL9499159

CCOc1ccc(-c2ccccc2C(O)CC)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 2/20 0.38
MAPK1 P28482 3/20 0.37
LTA4H P09960 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TAAR1 Q96RJ0 1/20 0.36
FAAH O00519 1/20 0.36
NQO1 P15559 1/20 0.36
RAB9A P51151 3/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HTT P42858 2/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL9498372 0.91 CYP4F2 (0.38) MAPTKDM4ENPC1MAPK1LTA4H
SCHEMBL9500172 0.91 CYP2D6 (0.40) MAPTKDM4ENPC1LTA4HKMT2A
SCHEMBL9498220 0.90 CYP11B1 (0.38) NPC1MAPK1MEN1KMT2ARAB9A
SCHEMBL9500255 0.88 LTA4H (0.41) MAPTKDM4ENPC1LTA4HRAB9A
SCHEMBL9499201 0.87 KDM4E (0.43) MAPTKDM4ENPC1LTA4HSMN1; SMN2
SCHEMBL9500276 0.87 KDM4E (0.43) MAPTKDM4ENPC1LTA4HSMN1; SMN2
SCHEMBL9498427 0.87 KDM4E (0.43) MAPTKDM4ENPC1LTA4HSMN1; SMN2
SCHEMBL9498386 0.87 KDM4E (0.43) MAPTKDM4ENPC1LTA4HSMN1; SMN2
SCHEMBL9498606 0.87 KDM4E (0.43) MAPTKDM4ENPC1LTA4HSMN1; SMN2
SCHEMBL9502022 0.82 CCR1 (0.44) NPC1MAPK1KMT2ARAB9ASMN1; SMN2

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