SCHEMBL269287

SCHEMBL269287

C[C@@H](NC(=O)c1ccc2cc(C(C)(C)C)ccc2n1)c1ccnc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.41
XIAP P98170 1/20 0.40
BIRC2 Q13490 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PABPC1 P11940 1/20 0.40
EIF4H Q15056 1/20 0.40
SCN9A Q15858 5/20 0.40
PDE2A O00408 3/20 0.39
TRPV1 Q8NER1 3/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
FLT1 P17948 1/20 0.36
KDR P35968 1/20 0.36
BRAF P15056 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
SCHEMBL265197 1.00 PPARG (0.41) PPARGXIAPBIRC2MEN1KMT2A
Hydrochloric Acid SCHEMBL264053 0.99 PPARG (0.41) PPARGXIAPBIRC2MEN1KMT2A
SCHEMBL264499 0.83 HPGDS (0.44) PPARGMEN1KMT2APABPC1EIF4H
SCHEMBL263436 0.80 MEN1 (0.47) MEN1KMT2APABPC1EIF4HSCN9A
Hydrochloric Acid SCHEMBL264982 0.79 MEN1 (0.47) MEN1KMT2APABPC1EIF4HSCN9A
SCHEMBL264576 0.76 PPARG (0.47) PPARGMEN1KMT2APABPC1EIF4H
SCHEMBL264373 0.75 PPARG (0.46) PPARGMEN1KMT2ATRPV1LMNA
SCHEMBL264363 0.75 PPARG (0.46) PPARGMEN1KMT2APDE2ATRPV1
SCHEMBL262685 0.75 PPARG (0.46) PPARGMEN1KMT2APDE2ATRPV1
SCHEMBL14147967 0.74 PPARG (0.44) PPARGPDE2ABRAF

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 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

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 PPARG 771/4885XIAP 4528/4885BIRC2 2538/4885

“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.