SCHEMBL14083103

SCHEMBL14083103

COc1cccnc1-c1ccc(C(=O)Nc2ccc(C(C)C)cc2)cc1F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.54
▸ KCNQ3 O43525 4/20 0.52
▸ KCNQ2 O43526 4/20 0.52
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ AURKB Q96GD4 1/20 0.47
▸ POLB P06746 3/20 0.46
▸ CASP3 P42574 2/20 0.46
▸ SENP7 Q9BQF6 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ TEK Q02763 1/20 0.46
▸ SENP8 Q96LD8 1/20 0.45
▸ SENP6 Q9GZR1 1/20 0.45
▸ KCNE1 P15382 1/20 0.45
▸ KCNQ1 P51787 1/20 0.45
▸ GRM4 Q14833 1/20 0.44

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
SCHEMBL14083306 0.92 TRPV1 (0.58) TRPV1KCNQ3KCNQ2NPC1RAB9A
SCHEMBL14083117 0.91 ALDH1A1 (0.51) TRPV1KCNQ3KCNQ2NPC1RAB9A
SCHEMBL14083096 0.90 KCNQ3 (0.56) TRPV1KCNQ3KCNQ2RAB9AAURKB
SCHEMBL14083384 0.89 TRPV1 (0.55) TRPV1KCNQ3KCNQ2NPC1RAB9A
SCHEMBL14083089 0.89 MEN1 (0.51) TRPV1KCNQ3KCNQ2NPC1RAB9A
SCHEMBL14083652 0.87 TRPV1 (0.57) TRPV1KCNQ3KCNQ2NPC1RAB9A
SCHEMBL14083110 0.86 KCNQ3 (0.72) KCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL14083102 0.86 TRPV1 (0.62) TRPV1SMN1; SMN2TP53MAPT
SCHEMBL14083098 0.86 SMN1; SMN2 (0.59) KCNQ3KCNQ2NPC1RAB9ASMN1; SMN2
SCHEMBL14083100 0.86 TRPV1 (0.64) TRPV1KCNQ3KCNQ2KDRTEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-20080200524-A1 Amide compounds as ion channel ligands and uses thereof KELLY MICHAEL G 2008-08-21 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — US disclosed
US-7338950-B2 Amide compounds as ion channel ligands and uses thereof RENOVIS, INC. (US) 2008-03-04 — — 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-20080200524-A1 Amide compounds as ion channel ligands and uses thereof TRPV1, TRPA1, TRPV2 TRPV1 1/4885KCNQ3 87/4885KCNQ2 67/4885

“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.

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