SCHEMBL14082199

SCHEMBL14082199

O=C(NC1CC1)c1ccc(-c2ccccn2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.65
▸ NPC1 O15118 1/20 0.65
▸ RAB9A P51151 1/20 0.65
▸ KMT2A Q03164 1/20 0.65
▸ SMN1; SMN2 Q16637 1/20 0.65
▸ SMYD3 Q9H7B4 2/20 0.57
▸ CYP46A1 Q9Y6A2 1/20 0.56
▸ RIPK1 Q13546 1/20 0.56
▸ MAPK14 Q16539 2/20 0.55
▸ TGFBR1 P36897 1/20 0.55
▸ TRPV1 Q8NER1 2/20 0.53
▸ HPGDS O60760 1/20 0.53
▸ ATR Q13535 1/20 0.53
▸ MCHR1 Q99705 1/20 0.53
▸ MAPK11 Q15759 1/20 0.52
▸ GRM5 P41594 1/20 0.51
▸ GABRA5 P31644 1/20 0.50
▸ MAPKAPK2 P49137 1/20 0.49

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
SCHEMBL14082198 0.94 GRM5 (0.58) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL14082162 0.93 GRM5 (0.57) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL21477359 0.91 TRPV1 (0.53) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL14082175 0.90 TRPV1 (0.54) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL14082232 0.88 ATR (0.58) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL7936347 0.84 DRD2 (0.50) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL14082188 0.83 SIGMAR1 (0.67) MEN1KMT2ASMN1; SMN2MCHR1
SCHEMBL14082229 0.80 KMT2A (0.53) KMT2ATRPV1HPGDSMCHR1
SCHEMBL2979351 0.79 RAB9A (1.00) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL14082343 0.79 MAPKAPK2 (0.54) MEN1NPC1RAB9AKMT2ASMN1; SMN2

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-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

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 MEN1 4218/4885NPC1 1061/4885RAB9A 1914/4885

“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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