SCHEMBL14083624

SCHEMBL14083624

O=C(Nc1ccnc(Cl)c1)c1ccc(-c2ncccc2Cl)cc1F

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.54
▸ CYP11B2 P19099 1/20 0.46
▸ GRM5 P41594 1/20 0.46
▸ GRM4 Q14833 2/20 0.45
▸ SMARCA2 P51531 3/20 0.44
▸ SMARCA4 P51532 2/20 0.44
▸ HDAC4 P56524 1/20 0.42
▸ NTRK1 P04629 1/20 0.42
▸ PPARG P37231 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
SCHEMBL14083575 0.89 TRPV1 (0.62) TRPV1CYP11B2
SCHEMBL14083572 0.87 TRPV1 (0.60) TRPV1CYP11B2GRM4NTRK1PPARG
SCHEMBL14083366 0.87 TRPV1 (0.53) TRPV1GRM5GRM4SMARCA2SMARCA4
SCHEMBL14083586 0.87 CYP11B2 (0.55) TRPV1CYP11B2GRM4
SCHEMBL14082764 0.86 TRPV1 (0.62) TRPV1CYP11B2GRM5GRM4
SCHEMBL14083622 0.86 TRPV1 (0.56) TRPV1CYP11B2
SCHEMBL14083629 0.85 NPC1 (0.58) TRPV1CYP11B2GRM4
SCHEMBL14083600 0.85 TRPV1 (0.53) TRPV1CYP11B2GRM4
SCHEMBL14083581 0.84 CYP11B2 (0.67) TRPV1CYP11B2GRM5
SCHEMBL14083627 0.84 NPC1 (0.60) TRPV1GRM4

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 1/4885CYP11B2 2314/4885GRM5 259/4885

“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.

Send feedback