SCHEMBL9429463

SCHEMBL9429463

COC(=O)c1noc(-c2ccccc2)c1C(=O)Nc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
PTGS1 P23219 1/20 0.49
FLT1 P17948 1/20 0.46
KDR P35968 1/20 0.46
ABL1 P00519 4/20 0.46
HTT P42858 1/20 0.46
SCN10A Q9Y5Y9 1/20 0.45
TP53 P04637 1/20 0.45
RORC P51449 1/20 0.45
TRPV1 Q8NER1 2/20 0.45

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
SCHEMBL9429300 0.91 SMN1; SMN2 (0.52) PTGS2SMN1; SMN2FLT1KDRABL1
SCHEMBL9428655 0.90 PTGS2 (0.51) PTGS2SMN1; SMN2FLT1KDRABL1
SCHEMBL9429412 0.89 HIF1A (0.56) SMN1; SMN2PTGS1TP53
SCHEMBL9428554 0.88 PTGS1 (0.50) SMN1; SMN2PTGS1FLT1KDRHTT
SCHEMBL9428463 0.84 KDM4E (0.54) PTGS2SMN1; SMN2PTGS1RORC
SCHEMBL9429179 0.83 PTGS2 (0.65) PTGS2SMN1; SMN2FLT1KDRABL1
SCHEMBL9429896 0.82 SMN1; SMN2 (0.52) PTGS2SMN1; SMN2FLT1KDRABL1
SCHEMBL9429668 0.81 HIF1A (0.57) SMN1; SMN2PTGS1TP53
SCHEMBL9429364 0.79 PTGS2 (0.62) PTGS2SMN1; SMN2FLT1KDRHTT
SCHEMBL9429341 0.78 MAPT (0.58) SMN1; SMN2FLT1KDRHTTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5328907-A Treatment of allograft rejection in mammals and antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1994-07-12 US disclosed
US-5108999-A For treating inflammation, autoimmune disease or allograft rejection in mammals SYNTEX (U.S.A.) INC. (US) 1992-04-28 US disclosed
US-5001124-A 4-isoxazolecarboxamide derivatives SYNTEX (U.S.A.) INC. (US) 1991-03-19 US disclosed