SCHEMBL264226

SCHEMBL264226

CC(C)(C)c1ccc2nc(C(=O)NCc3ccc4[nH]nnc4c3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NOD2 Q9HC29 1/20 0.44
NAMPT P43490 1/20 0.41
SCN9A Q15858 6/20 0.41
NR1H4 Q96RI1 4/20 0.40
EPHX2 P34913 4/20 0.40
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
SCN10A Q9Y5Y9 2/20 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
SCHEMBL269762 0.79 PDE2A (0.45) NR1H4
SCHEMBL269340 0.79 PDE2A (0.44) SCN10A
SCHEMBL4547702 0.77 MEN1 (0.44) MEN1KMT2ANOD2SCN9ANR1H4
SCHEMBL263422 0.74 PDE2A (0.46) NR1H4
SCHEMBL263787 0.74 PDE2A (0.45) SCN10A
SCHEMBL263436 0.71 MEN1 (0.47) MEN1KMT2ANOD2SCN9AHDAC3
Hydrochloric Acid SCHEMBL264982 0.71 MEN1 (0.47) MEN1KMT2ANOD2SCN9AHDAC3
SCHEMBL25497861 0.70 MEN1 (0.47) MEN1KMT2ASCN9ASCN10A
SCHEMBL4128938 0.70 TRPV1 (0.53)
SCHEMBL2905066 0.70 SCN9A (0.43) MEN1KMT2ASCN9AEPHX2SCN10A

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
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 US claimed
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-8134004-B2 Substituted N-bicyclicalkyl bicycliccarboxyamide compounds PFIZER INC. (US) 2012-03-13 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 US disclosed
US-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER INC 2009-10-08 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-20090253740-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLICCARBOXYAMIDE COMPOUNDS OPRL1, CNR1, TRPV1 MEN1 4051/4885KMT2A 4132/4885NOD2 352/4885

“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.