SCHEMBL12350141

SCHEMBL12350141

CCOc1ccc(CCc2nc3cc(-c4ccccc4C(C)(C)O)ccc3[nH]2)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.62
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
CNR2 P34972 1/20 0.39
NTRK1 P04629 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
NTRK2 Q16620 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 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
SCHEMBL1800570 0.90 TRPV1 (0.67) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL1796368 0.88 TRPV1 (0.62) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL12652898 0.88 TRPV1 (0.69) TRPV1ALDH1A1RAB9ANPC1NTRK1
SCHEMBL1798966 0.86 TRPV1 (0.66) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL12355516 0.86 TRPV1 (0.72) TRPV1RAB9ANPC1NTRK1SMN1; SMN2
SCHEMBL12350131 0.86 TRPV1 (0.64) TRPV1RAB9ANPC1NTRK1SMN1; SMN2
SCHEMBL1795026 0.85 TRPV1 (0.63) TRPV1RAB9ANPC1NTRK1SMN1; SMN2
SCHEMBL2241285 0.84 TRPV1 (0.85) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL12350135 0.83 ALDH1A1 (0.43) TRPV1ALDH1A1RAB9ANPC1CNR2
SCHEMBL1795997 0.83 TRPV1 (0.62) TRPV1RAB9ANPC1NTRK1NTRK2

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-20110190364-A1 BENZIMIDAZOLE MODULATORS OF VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2011-08-04 US disclosed
US-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 JANSSEN PHARMACEUTICA N.V. (BE) 2011-08-04 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 (2 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-20110190364-A1 BENZIMIDAZOLE MODULATORS OF VR1 VRK1, VRK2, VIL1 TRPV1 29/4885ALDH1A1 528/4885RAB9A 3985/4885
US-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 VRK1, VRK2, VIL1 TRPV1 29/4885ALDH1A1 528/4885RAB9A 3985/4885

“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.