SCHEMBL2009389

SCHEMBL2009389

Cn1ncc(CNC(=O)c2ccc3nc(C(F)(F)C(F)(F)F)ccc3c2)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
RORC P51449 4/20 0.38
EPHX2 P34913 4/20 0.38
NR1H4 Q96RI1 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
HPGDS O60760 1/20 0.37
PPARG P37231 1/20 0.37
DDR1 Q08345 4/20 0.36
NAMPT P43490 1/20 0.36
CASP6 P55212 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ROCK2 O75116 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
SCHEMBL2008896 0.91 TP53 (0.38) TP53RORCEPHX2KDM4EALDH1A1
SCHEMBL1843046 0.83 SCN9A (0.40) MAPTNAMPT
SCHEMBL1840774 0.81 ROCK2 (0.45) TP53KDM4EALDH1A1HPGDMAPT
SCHEMBL2009522 0.81 ROCK2 (0.45) TP53KDM4EALDH1A1HPGDMAPT
SCHEMBL2009523 0.81 ROCK2 (0.45) TP53KDM4EALDH1A1HPGDMAPT
SCHEMBL1842002 0.80 BRPF1 (0.41) RORCHPGDS
SCHEMBL1840778 0.80 BRPF1 (0.41) RORCHPGDS
SCHEMBL1840633 0.74 HPGD (0.41) TP53RORCEPHX2KDM4EALDH1A1
SCHEMBL1840121 0.73 BRPF1 (0.43)
SCHEMBL1839208 0.73 BRPF1 (0.43)

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-7964732-B2 Substituted bicyclocarboxyamide compounds PFIZER INC. (US) 2011-06-21 US disclosed
US-20100267769-A1 Substituted Bicyclocarboxyamide Compounds Pfizer, Inc. and Renovis Inc. 2010-10-21 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-20100267769-A1 Substituted Bicyclocarboxyamide Compounds TRPV1, OPRL1, CNR1 TP53 3844/4885RORC 862/4885EPHX2 2999/4885

“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.