SCHEMBL5887072

SCHEMBL5887072

Cc1nc(N2CCc3ccccc3C2)nc2c1ccc(=O)n2-c1ccc(C(=O)Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CETP P11597 1/20 0.39
ADAMTS4 O75173 5/20 0.38
RXRA P19793 1/20 0.37
SCN9A Q15858 2/20 0.36
IP6K1 Q92551 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL5886722 0.91 RXRA (0.46) ALDH1A1CETPADAMTS4RXRASCN9A
SCHEMBL5887156 0.90 ADAMTS4 (0.43) ALDH1A1CETPADAMTS4RXRASCN9A
SCHEMBL5886729 0.87 ALDH1A1 (0.37) ALDH1A1CETPADAMTS4RXRASCN9A
SCHEMBL5887057 0.86 DRD2 (0.41) ADAMTS4SCN9AMAPTHDAC6NPC1
SCHEMBL5887343 0.84 PRMT5 (0.43) ALDH1A1ADAMTS4MAPTKDM4EHDAC6
SCHEMBL5886750 0.84 ADAMTS4 (0.45) ALDH1A1ADAMTS4MAPT
SCHEMBL5887084 0.84 ALDH1A1 (0.42) ALDH1A1RXRAMAPTPKMNPC1
SCHEMBL5886716 0.84 SMN1; SMN2 (0.41) ALDH1A1MAPK1NPC1RAB9A
SCHEMBL5887024 0.83 MAPT (0.44) ALDH1A1ADAMTS4MAPTKDM4EHDAC6
SCHEMBL5887054 0.82 HDAC6 (0.46) ALDH1A1ADAMTS4MAPTHDAC6

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 disclosed
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors PHARMACIA ITALIA S.P.A. 2004-01-15 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 1860/4885CETP 3984/4885ADAMTS4 2688/4885

“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.