SCHEMBL5886835

SCHEMBL5886835

COCCNc1nc(C)c2ccc(=O)n(-c3ccc(C(=O)NCC4CCCCC4)cc3)c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.43
PDE7A Q13946 1/20 0.39
MLYCD O95822 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CA2 P00918 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
POLB P06746 2/20 0.37
MAPK8 P45983 3/20 0.37
MAPK9 P45984 2/20 0.37
MAPK10 P53779 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
P2RX7 Q99572 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL5886743 0.92 MMP13 (0.42) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5887431 0.91 MMP13 (0.41) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5887385 0.90 MAPT (0.41) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5887046 0.88 MMP13 (0.39) MMP13PDE7AMLYCDHDAC6CA2
SCHEMBL5886846 0.87 HPGD (0.54) POLBHPGDKDM4EALDH1A1LMNA
SCHEMBL5886712 0.87 LMNA (0.40) MMP13TDP1POLBHPGDALDH1A1
SCHEMBL5887055 0.87 ALDH1A1 (0.43) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5887360 0.87 MMP13 (0.41) MMP13MLYCDHDAC6CA2POLB
SCHEMBL5886819 0.86 EPHX2 (0.43) PDE7APOLBMAPK9MAPK10ALDH1A1
SCHEMBL5886797 0.86 MAPK8 (0.47) MAPK8MAPK9MAPK10ALDH1A1THRB

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 3469/4885PDE7A 1397/4885MLYCD 3072/4885

“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.