SCHEMBL5886906

SCHEMBL5886906

Cc1nc(N2CCC[C@H]2C(=O)O)nc2c1ccc(=O)n2-c1ccc(C(=O)NCC2CCCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.40
MLYCD O95822 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CA2 P00918 1/20 0.37
POLB P06746 2/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 2/20 0.36
THRB P10828 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
KIT P10721 1/20 0.35
TSHR P16473 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
NAMPT P43490 1/20 0.35
MAPK14 Q16539 2/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL5886972 0.88 MEN1 (0.37) MLYCDPOLBHPGDALDH1A1SMN1; SMN2
SCHEMBL5887620 0.87 HPGD (0.54) POLBHPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL5886775 0.87 MMP13 (0.43) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5886746 0.87 ALDH1A1 (0.44) POLBALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL5887294 0.85 MAPK8 (0.40) HPGDTHRBSMN1; SMN2LMNAMAPT
SCHEMBL5887335 0.85 L3MBTL1 (0.39) MLYCDCA2HPGDALDH1A1KDM4E
SCHEMBL5886844 0.85 MAPT (0.44) HPGDALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL5886885 0.84 MMP13 (0.41) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5886720 0.84 P2RX7 (0.41) MMP13MLYCDHDAC6CA2RAB9A
SCHEMBL5887213 0.83 HPGD (0.45) POLBHPGDALDH1A1KDM4ESMN1; SMN2

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 MMP13 3469/4885MLYCD 3072/4885HDAC6 1835/4885

“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.