SCHEMBL5887080

SCHEMBL5887080

CC(=O)c1ccc(Oc2nc(C)c3ccc(=O)n(-c4ccc(C(=O)NCc5ccc(S(C)(=O)=O)cc5)cc4)c3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.42
NR1H4 Q96RI1 2/20 0.42
RORC P51449 2/20 0.40
MAPK8 P45983 4/20 0.38
MAPK14 Q16539 2/20 0.38
CCR1 P32246 2/20 0.38
MMP13 P45452 2/20 0.38
MMP2 P08253 1/20 0.38
CYP3A4 P08684 1/20 0.38
STAT3 P40763 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
PTGS2 P35354 1/20 0.37
TP53 P04637 1/20 0.37
MAPK9 P45984 1/20 0.37
THRB P10828 1/20 0.36
MAPT P10636 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
SCHEMBL5886848 0.93 CCR1 (0.43) EPHX2NR1H4RORCMAPK8MAPK14
SCHEMBL5886905 0.92 RORC (0.41) EPHX2NR1H4RORCMAPK8MAPK14
SCHEMBL5886785 0.92 EPHX2 (0.40) EPHX2NR1H4RORCMAPK8MAPK14
SCHEMBL5886883 0.92 MAPK14 (0.45) EPHX2NR1H4RORCMAPK8MAPK14
SCHEMBL5887133 0.90 SMN1; SMN2 (0.40) EPHX2NR1H4MAPK8MAPK14MMP13
SCHEMBL5886768 0.89 HPGD (0.47) EPHX2MAPK14MMP13MMP2CYP3A4
SCHEMBL5887029 0.88 MAPK14 (0.48) EPHX2NR1H4MAPK14MMP13MMP2
SCHEMBL5886992 0.85 RECQL (0.44) SMN1; SMN2ALDH1A1MAPT
SCHEMBL5886839 0.84 MAPK14 (0.51) EPHX2NR1H4MAPK14MMP13MMP2
SCHEMBL5886787 0.84 RORC (0.41) EPHX2NR1H4RORCMAPK8CCR1

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-7019002-B2 Substituted on 8th position with benzoic acid, ester or amide groups; anticancer agents PHARMACIA & UPJOHN, S.P.A. (IT) 2006-03-28 US claimed
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors PHARMACIA ITALIA S.P.A. 2004-01-15 US claimed
US-7019002-B2 Substituted on 8th position with benzoic acid, ester or amide groups; anticancer agents PHARMACIA & UPJOHN, S.P.A. (IT) 2006-03-28 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-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors TERT, TERF2, TERF2IP EPHX2 2968/4885NR1H4 4783/4885RORC 3073/4885

“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.