SCHEMBL4332318

SCHEMBL4332318

Cc1ccnc(NC(=O)c2nc(CN3CCC(F)(F)CC3)c3ccccn23)c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.66
CNR1 P21554 6/20 0.66
TGFBR1 P36897 1/20 0.41
TGFBR2 P37173 1/20 0.41
NPC1 O15118 8/20 0.41
RAB9A P51151 8/20 0.41
KMT2A Q03164 4/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 3/20 0.40
METTL3 Q86U44 1/20 0.39
PKM P14618 1/20 0.39
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 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
SCHEMBL4336447 0.88 CNR2 (0.67) CNR2CNR1METTL3
SCHEMBL4324493 0.88 CNR2 (0.74) CNR2CNR1TGFBR1TGFBR2NPC1
SCHEMBL4331203 0.88 CNR1 (0.65) CNR2CNR1NPC1RAB9AKMT2A
SCHEMBL4331211 0.88 CNR1 (0.56) CNR2CNR1NPC1RAB9AKMT2A
SCHEMBL4336060 0.87 CNR2 (0.68) CNR2CNR1NPC1RAB9AKMT2A
SCHEMBL4468815 0.86 CNR2 (0.69) CNR2CNR1METTL3
SCHEMBL4328542 0.84 CNR2 (0.77) CNR2CNR1NPC1RAB9ASMN1; SMN2
SCHEMBL4340056 0.84 CNR2 (0.68) CNR2CNR1TGFBR1TGFBR2METTL3
SCHEMBL4326414 0.84 CNR2 (0.68) CNR2CNR1METTL3
SCHEMBL4334559 0.83 CNR2 (0.62) CNR2CNR1TGFBR1TGFBR2NPC1

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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 US disclosed
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 CNR2 1/4885CNR1 2/4885TGFBR1 1554/4885

“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.