SCHEMBL3038445

SCHEMBL3038445

CC(C)(C)c1ccc(CNC(=O)Cn2cnc3cccc(F)c32)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TP53 P04637 3/20 0.46
TSHR P16473 2/20 0.46
ENPP2 Q13822 2/20 0.43
POLB P06746 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
TRPA1 O75762 1/20 0.41
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL4973583 0.88 LMNA (0.52) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL3045467 0.88 SMN1; SMN2 (0.49) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL4975771 0.87 LMNA (0.54) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL4457066 0.86 LMNA (0.53) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL4976192 0.86 LMNA (0.50) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL4976631 0.85 SMN1; SMN2 (0.49) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL4974450 0.85 TRPV1 (0.51) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL4975293 0.85 LMNA (0.49) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL3044801 0.85 LMNA (0.48) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1
SCHEMBL3046393 0.84 KMT2A (0.48) TRPV1SMN1; SMN2LMNAL3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645784-B2 Benzimidazole derivatives ASTRAZENECA AB (SE) 2010-01-12 US claimed
EP-2042490-A2 Benzimidazole derivatives as vanilloid receptor antagonists AstraZeneca AB (SE) 2009-04-01 EP claimed
EP-1626964-B1 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2009-01-21 EP claimed
US-20060287377-A1 New benzimidazole derivatives ASTRAZENECA AB (SE) 2006-12-21 US claimed
EP-1626964-A2 NEW BENZIMIDAZOLE DERIVATIVES AstraZeneca AB (SE) 2006-02-22 EP claimed
WO-2004100865-A2 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-11-25 WO claimed
US-7645784-B2 Benzimidazole derivatives ASTRAZENECA AB (SE) 2010-01-12 US disclosed
EP-2042490-A2 Benzimidazole derivatives as vanilloid receptor antagonists AstraZeneca AB (SE) 2009-04-01 EP disclosed
EP-1626964-B1 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2009-01-21 EP disclosed
US-20060287377-A1 New benzimidazole derivatives ASTRAZENECA AB (SE) 2006-12-21 US disclosed
EP-1626964-A2 NEW BENZIMIDAZOLE DERIVATIVES AstraZeneca AB (SE) 2006-02-22 EP disclosed
WO-2004100865-A2 NEW BENZIMIDAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-11-25 WO 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-20060287377-A1 New benzimidazole derivatives CYP2C9, CDK9, CCNI TRPV1 1366/4885SMN1; SMN2 2297/4885LMNA 671/4885

“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.