SCHEMBL5886746

SCHEMBL5886746

Cc1nc(N2CCC[C@H]2C(=O)O)nc2c1ccc(=O)n2-c1ccc(C(=O)NCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
POLB P06746 2/20 0.44
MAPT P10636 4/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 3/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PKM P14618 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TP53 P04637 1/20 0.41
AADAT Q8N5Z0 6/20 0.41
RXFP1 Q9HBX9 1/20 0.39
F2 P00734 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
SCHEMBL5886844 0.92 MAPT (0.44) ALDH1A1MAPTGAAKDM4ERAB9A
SCHEMBL5887213 0.88 HPGD (0.45) ALDH1A1POLBMAPTGAAKDM4E
SCHEMBL5886972 0.88 MEN1 (0.37) ALDH1A1POLBMAPTRAB9ASMN1; SMN2
SCHEMBL5886906 0.87 MMP13 (0.40) ALDH1A1POLBMAPTGAAKDM4E
SCHEMBL5886779 0.86 MAPT (0.44) ALDH1A1POLBMAPTKDM4EMAPK1
SCHEMBL5887294 0.85 MAPK8 (0.40) MAPTMAPK1RAB9ASMN1; SMN2LMNA
SCHEMBL5887335 0.85 L3MBTL1 (0.39) ALDH1A1GAAKDM4ESMN1; SMN2LMNA
SCHEMBL5887290 0.85 ALDH1A1 (0.44) ALDH1A1POLBMAPTGAAKDM4E
SCHEMBL5887620 0.84 HPGD (0.54) ALDH1A1POLBMAPTGAAKDM4E
SCHEMBL5886891 0.84 TP53 (0.44) ALDH1A1POLBMAPTSMN1; SMN2LMNA

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 ALDH1A1 1860/4885POLB 77/4885MAPT 1614/4885

“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.