SCHEMBL10695590

SCHEMBL10695590

Oc1c(Cl)cc(C(F)(F)F)c(Cl)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 7/20 0.52
TSHR P16473 5/20 0.52
HPGD P15428 5/20 0.52
MAPK1 P28482 2/20 0.52
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
CYP3A4 P08684 3/20 0.39
RECQL P46063 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TTR P02766 1/20 0.39
CASP1 P29466 1/20 0.39
THRB P10828 2/20 0.36
KDR P35968 2/20 0.35
CYP1A2 P05177 2/20 0.35
ALOX15 P16050 2/20 0.35
ALOX12 P18054 2/20 0.35
CYP2C19 P33261 2/20 0.35

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
SCHEMBL10698002 0.83 HSD17B10 (0.43) HSD17B10TSHRHPGDMAPK1HTR3E
SCHEMBL1768795 0.78 CYP3A4 (0.50) HSD17B10TSHRHPGDMAPK1HTR3E
SCHEMBL8064762 0.77 HSD17B10 (0.52) HSD17B10TSHRHPGDMAPK1CYP3A4
SCHEMBL10707497 0.74 HPGD (0.48) HSD17B10TSHRHPGDMAPK1HTR3E
SCHEMBL10695573 0.74 HTR3E (0.37) HSD17B10TSHRHPGDMAPK1HTR3E
SCHEMBL7855792 0.73 TP53 (0.36) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10616182 0.73 ALDH1A1 (0.39) TSHRHTR3EHTR3BHTR3AHTR3D
SCHEMBL10482195 0.73 KDR (0.35) TSHRHPGDHTR3EHTR3BHTR3A
SCHEMBL10825784 0.73 HTR3E (0.43) HSD17B10TSHRHPGDMAPK1HTR3E
SCHEMBL8830349 0.72 NOTUM (0.35) HTR3EHTR3BHTR3AHTR3DHTR3C

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-0272533-A2 Substituted phenoxypyridines BAYER AG (DE) 1988-06-29 EP disclosed