SCHEMBL5886802

SCHEMBL5886802

CCCCC(CC)CNc1nc(C)c2ccc(=O)n(-c3ccc(C(=O)NCc4ccco4)cc3)c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.43
CYP2C9 P11712 4/20 0.43
CYP1A2 P05177 4/20 0.43
MAPT P10636 3/20 0.43
CYP2C19 P33261 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 7/20 0.42
KMT2A Q03164 5/20 0.42
KDM4E B2RXH2 4/20 0.42
MEN1 O00255 2/20 0.42
TSHR P16473 1/20 0.41
CYP2D6 P10635 2/20 0.41
TP53 P04637 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 2/20 0.41
HSD17B10 Q99714 2/20 0.41
USP2 O75604 1/20 0.40
PKM P14618 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL5886884 0.89 TP53 (0.40) HPGDMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL5887028 0.87 TDP1 (0.52) HPGDCYP2C9CYP1A2MAPTCYP2C19
SCHEMBL5887565 0.87 TP53 (0.40) HPGDMAPTSMN1; SMN2KMT2AMEN1
SCHEMBL5886980 0.86 L3MBTL1 (0.41) MAPTSMN1; SMN2TSHRTP53GAA
SCHEMBL5887243 0.84 ALDH1A1 (0.44) HPGDCYP2C9CYP1A2MAPTCYP2C19
SCHEMBL5886990 0.84 MAPT (0.41) HPGDCYP2C9MAPTCYP2C19SMN1; SMN2
Dimethylamine SCHEMBL5887655 0.84 TP53 (0.37) CYP1A2MAPTSMN1; SMN2TSHRTP53
SCHEMBL5886726 0.83 TDP1 (0.43) HPGDCYP2C9CYP1A2MAPTCYP2C19
SCHEMBL5886764 0.83 TDP1 (0.47) HPGDCYP2C9CYP1A2MAPTCYP2C19
SCHEMBL5886708 0.83 TP53 (0.48) HPGDCYP2C9CYP1A2MAPTCYP2C19

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 HPGD 1371/4885CYP2C9 3204/4885CYP1A2 3347/4885

“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.