SCHEMBL5260079

SCHEMBL5260079

CCNc1ccc2c(C=C(C(N)=O)c3ccccc3)c[nH]c2n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.37
HCAR3 P49019 1/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
KMT2A Q03164 1/20 0.33
FGFR4 P22455 3/20 0.32
ADORA1 P30542 2/20 0.31
NCF1 P14598 1/20 0.31
MAP3K7 O43318 1/20 0.31
TAB1 Q15750 1/20 0.31
PDE10A Q9Y233 2/20 0.31
PKM P14618 1/20 0.31
MAPK1 P28482 1/20 0.31
HAT1 O14929 1/20 0.31
EP300 Q09472 1/20 0.31

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
SCHEMBL5260077 1.00 ADORA2A (0.37) ADORA2AHCAR3CCNA2CDK2KMT2A
SCHEMBL5261678 0.91 ADORA2A (0.39) ADORA2AHCAR3CCNA2CDK2KMT2A
SCHEMBL5261682 0.91 ADORA2A (0.39) ADORA2AHCAR3CCNA2CDK2KMT2A
SCHEMBL5258654 0.88 ADORA2A (0.41) ADORA2AADORA1
SCHEMBL5258651 0.88 ADORA2A (0.41) ADORA2AADORA1
SCHEMBL5260147 0.88 ADORA2A (0.47) ADORA2AKMT2AFGFR4ADORA1PDE10A
SCHEMBL5260152 0.88 ADORA2A (0.47) ADORA2AKMT2AFGFR4ADORA1PDE10A
SCHEMBL5262263 0.88 NNMT (0.35) ADORA2AHCAR3CDK2KMT2AFGFR4
SCHEMBL5262258 0.88 NNMT (0.35) ADORA2AHCAR3CDK2KMT2AFGFR4
SCHEMBL5260321 0.86 ADORA1 (0.42) ADORA2ACDK2KMT2AADORA1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309590-B1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PFIZER ITALIA SRL (IT) 2007-09-19 EP claimed
US-20030004350-A1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN (IT) 2003-01-02 US claimed
US-6335342-B1 1H-PYRROLO(2,3-B)PYRIDINE DERIVATIVES; ANTICARCINOGENIC, ANTIMETASTASIS, ANTITUMOR AND ANTIPROLIFERATIVE AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-01-01 US claimed
EP-1309590-B1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PFIZER ITALIA SRL (IT) 2007-09-19 EP disclosed
US-20030004350-A1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN (IT) 2003-01-02 US disclosed
US-6486322-B1 Azaindole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA ITALIA S.P.A. (IT) 2002-11-26 US disclosed
US-6335342-B1 1H-PYRROLO(2,3-B)PYRIDINE DERIVATIVES; ANTICARCINOGENIC, ANTIMETASTASIS, ANTITUMOR AND ANTIPROLIFERATIVE AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-01-01 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-20030004350-A1 AZAINDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS FFAR4, AZI2, CNKSR1 ADORA2A 1105/4885HCAR3 72/4885CCNA2 315/4885

“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.