SCHEMBL20573238

SCHEMBL20573238

NC(=O)Oc1ccc(Cl)cc1-c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.45
PDE4D Q08499 1/20 0.42
CNR1 P21554 2/20 0.41
RELA Q04206 1/20 0.40
C5AR1 P21730 1/20 0.40
SCN9A Q15858 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
EIF4EBP1 Q13541 2/20 0.40
CHRM3 P20309 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 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
SCHEMBL20573324 0.89 PDE4D (0.45) PTGDR2PDE4DCNR1SCN9ACHRM3
SCHEMBL20573423 0.88 PDE4D (0.51) PTGDR2PDE4DEIF4EBP1MEN1KMT2A
SCHEMBL17797025 0.88 PARP1 (0.42) RELAC5AR1SCN9AMEN1KMT2A
SCHEMBL20573401 0.84 PTGDR2 (0.61) PTGDR2PDE4DC5AR1ALDH1A1CYP2C9
SCHEMBL20573244 0.83 PTGDR2 (0.45) PTGDR2RELAC5AR1CHRM3MEN1
SCHEMBL20573269 0.82 TUBB4A (0.44) RELASCN9AMEN1KMT2ACYP2C9
SCHEMBL17796952 0.82 CASP1 (0.43) PTGDR2SCN9APPARGPPARACHRM3
SCHEMBL20573247 0.81 SCN9A (0.47) PTGDR2SCN9ACHRM3
SCHEMBL20573264 0.81 TUBB4A (0.50) RELAMEN1ALDH1A1KMT2ACYP2C9
SCHEMBL17796943 0.81 PTGDR2 (0.49) PTGDR2SCN9ACHRM3KMT2ACYP2C9

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-3029026-B1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG A ST CO LTD (KR) 2018-12-05 EP disclosed