SCHEMBL5886757

SCHEMBL5886757

COc1ccccc1CCNc1nc(C)c2ccc(=O)n(-c3ccc(C(=O)NCc4ccco4)cc3)c2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.45
HPGD P15428 6/20 0.45
MAPK1 P28482 3/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPT P10636 6/20 0.44
KMT2A Q03164 3/20 0.42
GAA P10253 5/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 3/20 0.42
POLB P06746 2/20 0.42
GLA P06280 1/20 0.41
P2RY12 Q9H244 1/20 0.41
TP53 P04637 2/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL5886913 0.89 P2RY12 (0.43) ALDH1A1MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL5886705 0.88 HPGD (0.48) ALDH1A1HPGDMAPK1HSD17B10MAPT
SCHEMBL5887028 0.87 TDP1 (0.52) ALDH1A1HPGDMAPK1HSD17B10MAPT
SCHEMBL5886738 0.86 RAB9A (0.42) ALDH1A1HPGDMAPTKMT2ASMN1; SMN2
SCHEMBL5886958 0.86 MAPT (0.46) HPGDMAPTKMT2APOLBTP53
SCHEMBL5886764 0.86 TDP1 (0.47) ALDH1A1HPGDMAPK1HSD17B10MAPT
SCHEMBL5886812 0.85 TDP1 (0.47) ALDH1A1HPGDMAPK1HSD17B10MAPT
Dimethylamine SCHEMBL5887677 0.85 MAPT (0.42) MAPTKMT2ALMNAPOLBP2RY12
SCHEMBL5887210 0.85 MAPT (0.42) MAPTKMT2APOLBP2RY12MEN1
SCHEMBL5886925 0.84 TDP1 (0.46) ALDH1A1HPGDMAPK1HSD17B10MAPT

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 1860/4885HPGD 1371/4885MAPK1 855/4885

“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.