SCHEMBL12359243

SCHEMBL12359243

CC(O)c1ccccc1-c1ccc2[nH]c(CCc3ccc(OC(F)(F)C(F)(F)F)cc3)nc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.45
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
NTRK1 P04629 11/20 0.38
NTRK2 Q16620 8/20 0.38
PDE10A Q9Y233 2/20 0.37
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35

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
SCHEMBL12350136 0.92 TRPV1 (0.48) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL12350130 0.89 TRPV1 (0.47) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL1798091 0.88 TRPV1 (0.44) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL1795333 0.88 TRPV1 (0.45) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL1800046 0.88 TRPV1 (0.47) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL12355441 0.87 TRPV1 (0.47) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL12350135 0.86 ALDH1A1 (0.43) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL1798998 0.83 TRPV1 (0.44) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL1801376 0.82 TRPV1 (0.47) TRPV1RAB9ANPC1NTRK1NTRK2
SCHEMBL2239174 0.81 TRPV1 (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20110190344-A1 BENZIMIDAZOLE MODULATORS OF VR1 VRK1, VRK2, VIL1 TRPV1 29/4885RAB9A 3985/4885NPC1 750/4885

“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.