SCHEMBL14084036

SCHEMBL14084036

CCC(C)c1ccc(NC(=O)c2ccc(-c3ncccc3Cl)cn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.55
▸ NPC1 O15118 5/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ TP53 P04637 2/20 0.55
▸ NPSR1 Q6W5P4 2/20 0.55
▸ TRPV1 Q8NER1 5/20 0.52
▸ KMT2A Q03164 3/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ TRPV4 Q9HBA0 1/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MAPT P10636 3/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ POLB P06746 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
SCHEMBL14083929 0.90 TRPV1 (0.60) RAB9ANPC1ALDH1A1SMN1; SMN2TP53
SCHEMBL14083896 0.88 TRPV1 (0.67) RAB9ANPC1ALDH1A1SMN1; SMN2TP53
SCHEMBL14083999 0.83 TRPV1 (0.59) RAB9ANPC1ALDH1A1SMN1; SMN2TRPV1
SCHEMBL14083370 0.83 TRPV1 (0.52) RAB9ANPC1ALDH1A1SMN1; SMN2TP53
SCHEMBL14083056 0.83 TRPV1 (0.58) RAB9ANPC1ALDH1A1SMN1; SMN2TRPV1
SCHEMBL14084033 0.83 NPC1 (0.61) RAB9ANPC1ALDH1A1SMN1; SMN2TP53
SCHEMBL14083946 0.83 TRPV1 (0.54) ALDH1A1SMN1; SMN2NPSR1TRPV1KMT2A
SCHEMBL14083229 0.82 TRPV1 (0.47) RAB9ANPC1ALDH1A1SMN1; SMN2TP53
SCHEMBL14083912 0.81 TRPV1 (0.56) RAB9ANPC1ALDH1A1TRPV1
SCHEMBL14108052 0.81 TRPV1 (0.43) RAB9ANPC1SMN1; SMN2TP53TRPV1

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 RAB9A 1914/4885NPC1 1061/4885ALDH1A1 1577/4885

“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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