SCHEMBL3670285

SCHEMBL3670285

CN(Cc1cccc(-c2cc(C(F)(F)F)ccc2[O])c1)C(=O)c1cccnc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.43
TACR1 P25103 6/20 0.43
HSD17B1 P14061 2/20 0.43
HSD17B2 P37059 2/20 0.43
MLYCD O95822 1/20 0.42
GPBAR1 Q8TDU6 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 1/20 0.41
MGLL Q99685 1/20 0.41
BRAF P15056 1/20 0.41
HIF1A Q16665 1/20 0.41
EPAS1 Q99814 1/20 0.41
VNN1 O95497 1/20 0.41
NAMPT P43490 1/20 0.40

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
SCHEMBL3670286 0.90 HSD17B1 (0.45) TRPV4TACR1HSD17B1HSD17B2MLYCD
SCHEMBL3671609 0.88 MLYCD (0.52) TACR1HSD17B1HSD17B2MLYCDMEN1
SCHEMBL1950917 0.85 PTGDR2 (0.54) TRPV4
SCHEMBL3671696 0.79 NAMPT (0.51) HSD17B1HSD17B2KMT2ATSHRNAMPT
SCHEMBL3671611 0.78 PDK1 (0.54) TACR1HSD17B1HSD17B2MLYCDMEN1
SCHEMBL3668571 0.77 GPBAR1 (0.52) TRPV4TACR1GPBAR1
SCHEMBL3667568 0.76 MGLL (0.42) TACR1MEN1KMT2AMGLL
SCHEMBL3666331 0.76 MTOR (0.47) TACR1MGLLBRAF
SCHEMBL3671898 0.76 LIPE (0.46) TACR1MGLLBRAF
SCHEMBL3666874 0.75 ABHD6 (0.54) TACR1HSD17B2MEN1KMT2AMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2240434-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS Ligand Pharmaceuticals Inc. (US) 2010-10-20 EP disclosed
WO-2009089192-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2009-07-16 WO disclosed