SCHEMBL263879

SCHEMBL263879

C[C@@H](NC(=O)c1ccc2nc(C(C)(C)C)ccc2c1)c1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MAPK1 P28482 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.42
B3GNT2 Q9NY97 6/20 0.41
SMYD3 Q9H7B4 1/20 0.40
PDE2A O00408 3/20 0.40
NR1H4 Q96RI1 1/20 0.39
MAPT P10636 1/20 0.39
IMPDH2 P12268 2/20 0.38
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
GFER P55789 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 1.00 KMT2A (0.42) KMT2AMAPK1MEN1LMNAB3GNT2
SCHEMBL264324 0.91 PDE2A (0.41) KMT2AMAPK1B3GNT2SMYD3PDE2A
SCHEMBL263432 0.84 MAPK1 (0.42) KMT2AMAPK1MEN1LMNAB3GNT2
SCHEMBL269222 0.83 MAPK1 (0.41) KMT2AMAPK1MEN1LMNAB3GNT2
SCHEMBL1754180 0.79 LMNA (0.47) KMT2AMAPK1MEN1LMNANR1H4
SCHEMBL264194 0.79 SMYD3 (0.44) KMT2AMAPK1MEN1LMNASMYD3
SCHEMBL1753790 0.78 HPGD (0.47) KMT2AMAPK1MEN1LMNAROCK2
SCHEMBL27402835 0.77 NR1H4 (0.62) KMT2AMAPK1MEN1LMNAB3GNT2
SCHEMBL27402732 0.77 PDE2A (0.59) MAPK1B3GNT2SMYD3PDE2AMAPT
SCHEMBL27401397 0.77 PDE2A (0.59) MAPK1B3GNT2SMYD3PDE2AMAPT

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 4 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 claimed
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-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 KMT2A 4132/4885MAPK1 1388/4885MEN1 4051/4885

“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.