SCHEMBL264864

SCHEMBL264864

C[C@@H](N)c1ccc2nn[nH]c2c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 2/20 0.38
ADRB2 P07550 1/20 0.35
EIF4A3 P38919 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SCN4A P35499 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PDE2A O00408 1/20 0.30

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
Hydrochloric Acid SCHEMBL263971 0.98 SCN10A (0.37) SCN10AADRB2EIF4A3NPC1RAB9A
SCHEMBL7968994 0.85 SCN10A (0.43) SCN10AEIF4A3NPC1RAB9AMEN1
Hydrochloric Acid SCHEMBL3932764 0.84 ADRB2 (0.34) SCN10AADRB2
SCHEMBL24481561 0.82 SCN10A (0.32) SCN10AEIF4A3
SCHEMBL502177 0.82 SCN10A (0.32) SCN10AEIF4A3
SCHEMBL265289 0.81 SCN10A (0.41) SCN10A
SCHEMBL26999655 0.79 SCN10A (0.48) SCN10AMEN1ALDH1A1MAPTKMT2A
SCHEMBL31229266 0.77 PTGS2 (0.45) MEN1MAPTKMT2A
SCHEMBL25562963 0.72 GPR84 (0.36) SCN10A
Benzotriazole SCHEMBL241937 0.72 TAAR1 (0.40) NPC1RAB9AMEN1ALDH1A1POLB

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-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 SCN10A 131/4885ADRB2 281/4885EIF4A3 2318/4885

“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.