SCHEMBL14082698

SCHEMBL14082698

CCCCc1ccc(NC(=O)c2ccc(-c3cc(C(F)(F)F)ccn3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 10/20 0.55
▸ PLK1 P53350 1/20 0.52
▸ KDM4E B2RXH2 2/20 0.51
▸ KDM1A O60341 1/20 0.49
▸ HDAC1 Q13547 1/20 0.49
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ GALR3 O60755 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ NFKB2 Q00653 1/20 0.47
▸ RELA Q04206 1/20 0.47
▸ MCHR1 Q99705 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ TDO2 P48775 1/20 0.46

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
SCHEMBL14082688 0.86 TRPV1 (0.73) TRPV1KDM1AHDAC1NPC1RAB9A
SCHEMBL14082414 0.85 TRPV1 (0.57) TRPV1KDM4ENPC1RAB9AALDH1A1
SCHEMBL5934533 0.84 TRPV1 (0.67) TRPV1
SCHEMBL14082671 0.83 TRPV1 (0.57) TRPV1HDAC1NPC1RAB9AALDH1A1
SCHEMBL14082633 0.82 TRPV1 (0.65) TRPV1HDAC1NPC1RAB9ATDO2
SCHEMBL14082636 0.81 TRPV1 (0.66) TRPV1KDM4EKDM1AHDAC1NPC1
SCHEMBL14082629 0.81 TRPV1 (0.70) TRPV1KDM4ENPC1RAB9AMAPT
SCHEMBL14082697 0.81 TRPV1 (0.60) TRPV1HDAC1NPC1RAB9ASMN1; SMN2
SCHEMBL14082630 0.81 TRPV1 (0.60) TRPV1KDM4EKDM1AHDAC1NPC1
SCHEMBL14082259 0.81 TRPV1 (0.67) TRPV1KDM4E

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 1/4885PLK1 2975/4885KDM4E 4231/4885

“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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