SCHEMBL5886784

SCHEMBL5886784

Cc1nc(N2CCc3ccccc3C2)nc2c1ccc(=O)n2-c1ccc(C(=O)Nc2cccc(C#N)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.47
SCN9A Q15858 2/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
MAPK14 Q16539 3/20 0.40
ROCK2 O75116 3/20 0.40
MAPT P10636 2/20 0.40
MPO P05164 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
RPS6KA2 Q15349 1/20 0.39
TP53 P04637 1/20 0.39
PTPN11 Q06124 1/20 0.38
PDGFRB P09619 1/20 0.38
KDR P35968 1/20 0.38
CSNK2A1 P68400 1/20 0.38
BTK Q06187 1/20 0.38
ADAMTS4 O75173 1/20 0.38

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
SCHEMBL5886800 0.86 NOD1 (0.50) SCN9AKCNH2SCN5AMAPK14MAPT
SCHEMBL5886828 0.84 NAMPT (0.49) NAMPTROCK2MAPTTP53ADAMTS4
SCHEMBL5886740 0.82 NOD1 (0.53) MAPTTP53
SCHEMBL5886722 0.81 RXRA (0.46) SCN9AMAPTPTPN11ADAMTS4
SCHEMBL5887057 0.81 DRD2 (0.41) SCN9AMAPTADAMTS4
SCHEMBL5887072 0.80 ALDH1A1 (0.40) SCN9AMAPTADAMTS4
SCHEMBL5887156 0.79 ADAMTS4 (0.43) SCN9AADAMTS4
SCHEMBL5886750 0.79 ADAMTS4 (0.45) NAMPTROCK2MAPTTP53ADAMTS4
SCHEMBL5887343 0.79 PRMT5 (0.43) MAPTADAMTS4
SCHEMBL5886716 0.79 SMN1; SMN2 (0.41) MAPK14TP53KDR

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-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
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors PHARMACIA ITALIA S.P.A. 2004-01-15 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 NAMPT 527/4885SCN9A 4214/4885KCNH2 4055/4885

“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.