SCHEMBL264324

SCHEMBL264324

CC(NC(=O)c1ccc2nc(C(C)(C)C(F)(F)F)ccc2c1)c1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 11/20 0.41
B3GNT2 Q9NY97 5/20 0.40
KMT2A Q03164 1/20 0.38
SMYD3 Q9H7B4 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL269225 0.91 KMT2A (0.42) PDE2AB3GNT2KMT2ASMYD3MAPK1
SCHEMBL263879 0.91 KMT2A (0.42) PDE2AB3GNT2KMT2ASMYD3MAPK1
SCHEMBL262974 0.84 ROCK2 (0.43) PDE2AB3GNT2
SCHEMBL265195 0.80 SMYD3 (0.42) PDE2AKMT2ASMYD3
SCHEMBL1644118 0.78 RORC (0.36) PDE2AKMT2AMAPK1
SCHEMBL1285387 0.78 TRPV1 (0.39) PDE2A
SCHEMBL1839109 0.76 ROCK2 (0.35) PDE2A
SCHEMBL263432 0.75 MAPK1 (0.42) PDE2AB3GNT2KMT2AMAPK1
SCHEMBL15353608 0.74 GSK3B (0.42) KMT2AMAPK1MAPT
SCHEMBL269222 0.74 MAPK1 (0.41) B3GNT2KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PDE2A 2484/4885B3GNT2 1023/4885KMT2A 4132/4885

“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.