SCHEMBL5886943

SCHEMBL5886943

CCCCCCCCNC(=O)c1ccc(-n2c(=O)ccc3c(C)nc(NCCN4CCOCC4)nc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
HTT P42858 3/20 0.45
TSHR P16473 2/20 0.45
USP2 O75604 2/20 0.45
HPGDS O60760 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TYRO3 Q06418 1/20 0.43
MERTK Q12866 1/20 0.43
GAS6 Q14393 1/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
POLB P06746 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL5886692 0.87 HPGDS (0.42) HTTTSHRHPGDSL3MBTL1POLB
SCHEMBL5887628 0.87 L3MBTL1 (0.45) TSHRL3MBTL1ALDH1A1KDM4ETP53
SCHEMBL5886813 0.87 HPGD (0.46) HSD17B10HTTUSP2HPGDSL3MBTL1
SCHEMBL5887172 0.86 L3MBTL1 (0.44) L3MBTL1ALDH1A1KDM4ETP53GAA
SCHEMBL5886751 0.86 ALDH1A1 (0.48) HTTHPGDSPOLBALDH1A1KDM4E
SCHEMBL5887074 0.85 MAPK14 (0.49) HPGDSKDM4E
SCHEMBL5886760 0.85 L3MBTL1 (0.43) HSD17B10TSHRL3MBTL1ALDH1A1KDM4E
SCHEMBL5886903 0.85 MAPT (0.46) L3MBTL1ALDH1A1KDM4ETP53GAA
SCHEMBL5886819 0.84 EPHX2 (0.43) HTTHPGDSL3MBTL1POLBALDH1A1
SCHEMBL5886927 0.84 SMN1; SMN2 (0.51) HSD17B10USP2HPGDSL3MBTL1POLB

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 2 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

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 HSD17B10 3930/4885HTT 1319/4885TSHR 3292/4885

“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.