SCHEMBL5886867

SCHEMBL5886867

Cc1nc(N2CCN(C)CC2)nc2c1ccc(=O)n2-c1ccc(C(=O)NCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.48
EPHX2 P34913 2/20 0.47
KMT2A Q03164 1/20 0.46
TACR1 P25103 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
KDM1A O60341 1/20 0.41
HDAC1 Q13547 1/20 0.41
LSS P48449 1/20 0.41
CTNNB1 P35222 2/20 0.41
TCF7L2 Q9NQB0 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TRPV4 Q9HBA0 1/20 0.40
MAPK14 Q16539 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
SCHEMBL5886791 0.92 ENPP2 (0.48) BRAFEPHX2KMT2ACYP2C19LSS
SCHEMBL5887405 0.92 SMN1; SMN2 (0.42) BRAFEPHX2KMT2ACYP2C19LSS
SCHEMBL5887306 0.92 ME2 (0.42) BRAFEPHX2KMT2ACYP2C19LSS
SCHEMBL5886763 0.92 SMN1; SMN2 (0.42) BRAFEPHX2KMT2ACYP2C19LSS
SCHEMBL5886918 0.92 CTNNB1 (0.43) BRAFEPHX2KMT2ATACR1CYP2C19
SCHEMBL5887146 0.91 CTNNB1 (0.43) BRAFEPHX2KMT2ACYP2C19HDAC1
SCHEMBL5887548 0.90 KMT2A (0.46) EPHX2KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL5887410 0.90 SMN1; SMN2 (0.46) BRAFEPHX2KMT2ACYP2C9CYP2C19
SCHEMBL5886773 0.89 KMT2A (0.46) EPHX2KMT2ACYP2C19ACE2KDM1A
SCHEMBL5886889 0.89 MAPK10 (0.45) BRAFEPHX2KMT2ACYP2C19MAPK14

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 BRAF 1390/4885EPHX2 2968/4885KMT2A 1530/4885

“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.