SCHEMBL2415072

SCHEMBL2415072

CC(C)(O)c1cnc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
CYP11B2 P19099 3/20 0.37
CYP11B1 P15538 2/20 0.37
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
NPSR1 Q6W5P4 3/20 0.35
PLAU P00749 1/20 0.35
MAOB P27338 1/20 0.35
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL13165466 0.83 ALDH1A1 (0.44) ALDH1A1KMT2ANPSR1PLAUMAPK1
SCHEMBL17177782 0.82 CHRNB2 (0.38) ALDH1A1CYP11B2CYP11B1KMT2APIK3CA
SCHEMBL17173641 0.82 ALDH1A1 (0.36) ALDH1A1CYP11B2CYP11B1KMT2APLAU
SCHEMBL15201125 0.81 GCK (0.44) ALDH1A1CYP11B2PLAU
SCHEMBL20033736 0.79 ALDH1A1 (0.42) ALDH1A1KMT2ANPSR1PLAUMAPK1
SCHEMBL31214124 0.79 ALDH1A1 (0.42) ALDH1A1KMT2ANPSR1PLAUMAPK1
SCHEMBL17196427 0.77 L3MBTL1 (0.42) ALDH1A1KMT2AMEN1NPSR1MAOB
SCHEMBL21419053 0.77 KMT2A (0.46) ALDH1A1CYP11B2KMT2AMEN1MAOB
SCHEMBL20033674 0.76 ALDH1A1 (0.40) ALDH1A1NPSR1MAPK1SMN1; SMN2
SCHEMBL15201780 0.76 GCK (0.44) ALDH1A1KMT2AMEN1NPSR1PLAU

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8026241-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2011-09-27 US disclosed
WO-2010092342-A1 ORGANOSILICON COMPOUNDS AND THEIR USE AS THE MODULATORS OF THE TRPV1 RECEPTOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-19 WO disclosed
US-7582761-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-09-01 US disclosed
US-20090143575-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS BALAN CHENERA 2009-06-04 US disclosed
EP-1551811-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS Amgen Inc. (US) 2005-07-13 EP disclosed
US-20040152690-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2004-08-05 US disclosed
WO-2004035549-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS AMGEN INC. (US) 2004-04-29 WO 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 (2 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-20090143575-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPV3, TRPV2 ALDH1A1 2629/4885CYP11B2 2240/4885CYP11B1 2541/4885
US-20040152690-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV3, TRPV2 ALDH1A1 2522/4885CYP11B2 1810/4885CYP11B1 1967/4885

“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.