SCHEMBL20124890

SCHEMBL20124890

Cc1ccc(F)cc1OC[C@H](C)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
ALOX15 P16050 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
ACHE P22303 3/20 0.43
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
IL6 P05231 1/20 0.42
LMNA P02545 1/20 0.42
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PKM P14618 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
SCHEMBL20804977 0.86 FFAR1 (0.46) FFAR1FFAR4ALOX15KDM4ECYP1A2
SCHEMBL1158620 0.82 ADRB2 (0.54) CYP1A2ACHEADRB2LMNA
SCHEMBL25974313 0.82 FFAR1 (0.46) FFAR1FFAR4ALOX15KDM4ECYP1A2
SCHEMBL773187 0.82 ALOX15 (0.68) FFAR1FFAR4ALOX15KDM4ECYP1A2
SCHEMBL14300877 0.81 FFAR1 (0.46) FFAR1FFAR4LMNACYP2C19ALDH1A1
SCHEMBL3629149 0.78 KDM4E (0.68) ALOX15KDM4ECYP1A2ADRB2ADRB1
SCHEMBL25974447 0.77 LMNA (0.39) LMNACYP2C19
SCHEMBL23047176 0.77 CYP2C19 (0.44) KDM4ECYP1A2ADRB2ADRB1ADRB3
SCHEMBL29559341 0.77 FFAR1 (0.42) FFAR1FFAR4ALOX15KDM4ECYP1A2
SCHEMBL6832641 0.76 FFAR1 (0.49) FFAR1FFAR4KDM4ECYP1A2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970275-B1 PROTEIN KINASE C INHIBITORS AND USES THEREOF RIGEL PHARMACEUTICALS INC (US) 2018-05-09 EP disclosed