SCHEMBL13763517

SCHEMBL13763517

CC(C)(C)c1ccc(C(=O)Nc2ccc3c(c2)OCC(CO)N3)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
NR1H4 Q96RI1 5/20 0.40
TRPV1 Q8NER1 3/20 0.39
CYP3A4 P08684 1/20 0.39
CYP19A1 P11511 1/20 0.39
CYP2C9 P11712 1/20 0.39
ROCK2 O75116 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
DHODH Q02127 1/20 0.37
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL13544357 1.00 NPC1 (0.44) NPC1RAB9ANR1H4TRPV1CYP3A4
SCHEMBL13763397 1.00 NPC1 (0.44) NPC1RAB9ANR1H4TRPV1CYP3A4
SCHEMBL13763399 0.90 NPC1 (0.44) NPC1RAB9ANR1H4TRPV1PPARG
SCHEMBL13763401 0.90 NPC1 (0.44) NPC1RAB9ANR1H4TRPV1PPARG
SCHEMBL13763512 0.90 NPC1 (0.44) NPC1RAB9ANR1H4TRPV1PPARG
SCHEMBL13763520 0.89 RAB9A (0.39) NPC1RAB9ANR1H4TRPV1MAPT
SCHEMBL13763310 0.89 RAB9A (0.39) NPC1RAB9ANR1H4TRPV1MAPT
SCHEMBL13763351 0.89 RAB9A (0.39) NPC1RAB9ANR1H4TRPV1MAPT
SCHEMBL5365489 0.85 NPC1 (0.41) NPC1RAB9ANR1H4CYP3A4CYP19A1
SCHEMBL5133343 0.85 NPC1 (0.41) NPC1RAB9ANR1H4CYP3A4CYP19A1

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-7576099-B2 Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same RENOVIS, INC. (US) 2009-08-18 US disclosed
US-20080300243-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same RENOVIS, INC. 2008-12-04 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-20080300243-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same TRPV1, TRPA1, TRPV2 NPC1 959/4885RAB9A 2274/4885NR1H4 736/4885

“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.