SCHEMBL5887044

SCHEMBL5887044

CCCCCCCCNC(=O)c1ccc(-n2c(=O)ccc3c(C)nc(N4CCNCC4)nc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
HDAC6 Q9UBN7 2/20 0.41
GAA P10253 2/20 0.40
NAAA Q02083 2/20 0.39
RXFP1 Q9HBX9 1/20 0.38
HDAC3 O15379 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
ALDH1A1 P00352 4/20 0.37
CYP1A2 P05177 3/20 0.37
TLR2 O60603 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
HSD17B10 Q99714 2/20 0.37
USP2 O75604 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
MLYCD O95822 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KHK P50053 1/20 0.37

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
SCHEMBL5886981 0.92 L3MBTL1 (0.44) L3MBTL1HDAC6GAANAAARXFP1
SCHEMBL5887435 0.89 L3MBTL1 (0.41) L3MBTL1HDAC6GAANAAARXFP1
SCHEMBL5886860 0.86 USP25 (0.46) RXFP1ALDH1A1CYP1A2CASP1CASP7
SCHEMBL5886897 0.85 USP28 (0.40) HDAC3HDAC8ALDH1A1CYP1A2CASP1
SCHEMBL5887054 0.85 HDAC6 (0.46) L3MBTL1HDAC6GAANAAAALDH1A1
SCHEMBL5886857 0.84 MAPT (0.45) RXFP1ALDH1A1CYP1A2CASP1CASP7
SCHEMBL5887102 0.83 ALDH1A1 (0.40) ALDH1A1CYP1A2CASP1CASP7HSD17B10
SCHEMBL5886885 0.82 MMP13 (0.41) HDAC6GAAHDAC3HDAC8ALDH1A1
SCHEMBL5887335 0.82 L3MBTL1 (0.39) L3MBTL1GAANAAARXFP1ALDH1A1
SCHEMBL5886739 0.82 USP25 (0.34) HDAC6ALDH1A1CYP1A2CASP1CASP7

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 L3MBTL1 3053/4885HDAC6 1835/4885GAA 2823/4885

“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.