SCHEMBL1167299

SCHEMBL1167299

CC(=O)c1ccc(Cn2ccc(NC(=O)c3nc(C)oc3-c3cccc(OC(F)(F)F)c3)n2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 11/20 0.55
TP53 P04637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
SCD O00767 1/20 0.39
CACNA1G O43497 2/20 0.38
CACNA1H O95180 2/20 0.38
CACNA1I Q9P0X4 2/20 0.38
TSHR P16473 2/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
STIM1 Q13586 1/20 0.36
ORAI1 Q96D31 1/20 0.36
ORAI3 Q9BRQ5 1/20 0.36
NPC1 O15118 1/20 0.36

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
SCHEMBL2330327 0.88 FPR2 (0.68) FPR2CACNA1H
SCHEMBL1167420 0.86 FPR2 (0.52) FPR2KDM4ETSHRALDH1A1HPGD
SCHEMBL1167101 0.86 FPR2 (0.55) FPR2TP53KDM4ESCDCACNA1G
SCHEMBL1166667 0.85 FPR2 (0.55) FPR2TP53KDM4ESCDCACNA1G
SCHEMBL1167865 0.77 FPR2 (0.54) FPR2TP53KDM4ETSHRALDH1A1
SCHEMBL2324563 0.76 FPR2 (0.67) FPR2
SCHEMBL1167277 0.76 FPR2 (0.56) FPR2MEN1KMT2A
SCHEMBL1166778 0.76 TP53 (0.56) FPR2TP53KDM4ECACNA1GCACNA1H
SCHEMBL1166924 0.76 FPR2 (0.52) FPR2TP53KDM4ETSHRMEN1
SCHEMBL2327628 0.76 FPR2 (0.57) FPR2MEN1KMT2A

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
US-20110034516-A1 AMINOPYRAZOLE DERIVATIVES ACTELION (CH) 2011-02-10 US claimed
US-20110034516-A1 AMINOPYRAZOLE DERIVATIVES ACTELION (CH) 2011-02-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110034516-A1 AMINOPYRAZOLE DERIVATIVES CYP3A43, CYP1A2, CYP3A5 FPR2 1074/4885TP53 3386/4885KDM4E 1994/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.