SCHEMBL9429043

SCHEMBL9429043

CCOC(=O)c1noc(C)c1C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.65
ALDH1A1 P00352 4/20 0.62
GHSR Q92847 3/20 0.56
TP53 P04637 3/20 0.56
MAPT P10636 2/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
KDM4E B2RXH2 2/20 0.55
GPBAR1 Q8TDU6 1/20 0.55
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
TARBP2 Q15633 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL9428918 0.89 HTT (0.67) HTTALDH1A1TP53MAPTMEN1
SCHEMBL9422982 0.87 HTT (0.68) HTTALDH1A1GHSRTP53MAPT
SCHEMBL9429860 0.87 HTT (0.64) HTTALDH1A1TP53MAPTKDM4E
SCHEMBL9423028 0.85 HTT (0.62) HTTALDH1A1TP53MAPTKDM4E
SCHEMBL9428786 0.85 HTT (0.65) HTTALDH1A1TP53MAPTLMNA
SCHEMBL9429944 0.84 KDM4E (0.53) HTTALDH1A1GHSRTP53MAPT
SCHEMBL9423132 0.84 HTT (0.64) HTTALDH1A1TP53MAPTMEN1
SCHEMBL9422920 0.84 HTT (0.61) HTTALDH1A1GHSRTP53MAPT
SCHEMBL9429690 0.83 GPBAR1 (0.60) GHSRMEN1KMT2AKDM4EGPBAR1
SCHEMBL9423200 0.82 HTT (0.61) HTTALDH1A1TP53MAPTLMNA

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