SCHEMBL5886763

SCHEMBL5886763

Cc1nc(N2CCN(C(=O)O)CC2)nc2c1ccc(=O)n2-c1ccc(C(=O)NCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
MEN1 O00255 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
ENPP2 Q13822 2/20 0.41
BRAF P15056 5/20 0.41
LSS P48449 1/20 0.40
EPHX2 P34913 2/20 0.40
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
MAPK14 Q16539 1/20 0.39
MAPT P10636 1/20 0.39
P2RX3 P56373 1/20 0.39
NAMPT P43490 1/20 0.39

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
SCHEMBL5886791 0.94 ENPP2 (0.48) SMN1; SMN2MEN1CYP2C19KMT2AENPP2
SCHEMBL5886889 0.92 MAPK10 (0.45) SMN1; SMN2MEN1CYP2C19KMT2AENPP2
SCHEMBL5886918 0.92 CTNNB1 (0.43) SMN1; SMN2MEN1CYP2C19KMT2ABRAF
SCHEMBL5886867 0.92 BRAF (0.48) CYP2C19KMT2ABRAFLSSEPHX2
SCHEMBL5887410 0.92 SMN1; SMN2 (0.46) SMN1; SMN2MEN1CYP2C19KMT2AENPP2
SCHEMBL5886912 0.91 ME2 (0.43) SMN1; SMN2MEN1CYP2C19KMT2AENPP2
SCHEMBL5886882 0.91 MAPT (0.43) SMN1; SMN2MEN1CYP2C19KMT2ALMNA
SCHEMBL5887405 0.91 SMN1; SMN2 (0.42) SMN1; SMN2MEN1CYP2C19KMT2AENPP2
SCHEMBL5887306 0.91 ME2 (0.42) SMN1; SMN2MEN1CYP2C19KMT2AENPP2
SCHEMBL5887146 0.90 CTNNB1 (0.43) SMN1; SMN2MEN1CYP2C19KMT2AENPP2

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 SMN1; SMN2 2219/4885MEN1 2183/4885CYP2C19 2232/4885

“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.