SCHEMBL5886756

SCHEMBL5886756

Cc1nc(N2CCC(Cc3ccccc3)CC2)nc2c1ccc(=O)n2-c1ccc(C(=O)NCc2ccc(F)cc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.41
CCR3 P51677 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TRPV1 Q8NER1 3/20 0.39
KDM4E B2RXH2 1/20 0.39
GPR6 P46095 1/20 0.39
MAPK8 P45983 1/20 0.39
USP2 O75604 1/20 0.38
TLR9 Q9NR96 1/20 0.38
SCN9A Q15858 2/20 0.38
MCHR1 Q99705 2/20 0.38
CTNNB1 P35222 1/20 0.38
TCF7L2 Q9NQB0 1/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL5886956 0.89 CTNNB1 (0.44) PPARGMAPK8CTNNB1TCF7L2NAMPT
SCHEMBL5887179 0.89 MEN1 (0.50) MEN1KMT2ASCN9AMCHR1
SCHEMBL5886769 0.89 PPARG (0.43) PPARGMEN1KMT2ACTNNB1TCF7L2
SCHEMBL5886999 0.88 KMT2A (0.41) PPARGKMT2ACTNNB1TCF7L2NAMPT
SCHEMBL5887369 0.87 KDM4E (0.41) PPARGMEN1KMT2ATRPV1KDM4E
SCHEMBL5887280 0.87 CTNNB1 (0.40) PPARGMEN1KMT2ACTNNB1TCF7L2
SCHEMBL5886836 0.86 KLKB1 (0.40) PPARGMEN1KMT2AMCHR1CTNNB1
SCHEMBL5887137 0.86 CTNNB1 (0.41) PPARGGPR6CTNNB1TCF7L2NAMPT
SCHEMBL5887034 0.86 NAMPT (0.39) PPARGMEN1KMT2ACTNNB1TCF7L2
SCHEMBL5886742 0.86 CTNNB1 (0.43) PPARGMEN1KMT2AKDM4ECTNNB1

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 PPARG 3749/4885CCR3 4254/4885MEN1 2183/4885

“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.