SCHEMBL27641337

SCHEMBL27641337

CCCc1c(O)ccc(C(C)C=O)c1O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HSP90AB1 P08238 1/20 0.35
▸ PRKCI P41743 1/20 0.35
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ ADRB2 P07550 1/20 0.30
▸ ADRB1 P08588 1/20 0.30
▸ DRD3 P35462 1/20 0.30
▸ LDHA P00338 1/20 0.30
▸ LDHB P07195 1/20 0.30

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
SCHEMBL17789590 0.80 GCGR (0.38) HSP90AB1PRKCICNR1CNR2TSHR
SCHEMBL27641334 0.79 PRKCI (0.39) HSP90AB1PRKCICNR1CNR2ALDH1A1
SCHEMBL27691527 0.73 ERN1 (0.32) —
SCHEMBL27691522 0.73 MAPK1 (0.34) ESR1ESR2
SCHEMBL27691695 0.73 ADRB2 (0.38) ADRB2ADRB1
SCHEMBL3881959 0.73 CYSLTR2 (0.43) PRKCICNR1CNR2
SCHEMBL9821864 0.70 PRKCI (0.44) HSP90AB1PRKCIKDM4E
SCHEMBL5198498 0.70 MEN1 (0.50) PRKCICNR1CNR2ALDH1A1HPGD
SCHEMBL1760417 0.70 CNR1 (0.50) PRKCICNR1CNR2ALDH1A1HPGD
SCHEMBL30027246 0.70 CNR1 (0.50) PRKCICNR1CNR2ALDH1A1HPGD

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
CN-1882524-A 4- ((phenoxyalkyl) thio) -phenoxyacetic acids and analogs JANSSEN PHARMACEUTICA NV (BE) 2006-12-20 — — CN disclosed
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