SCHEMBL4523618

SCHEMBL4523618

CC(C)(C)OC(=O)n1c(COc2ccc(C(F)(F)F)cc2)nc2cc(B3OC(C)(C)C(C)(C)O3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.40
AAK1 Q2M2I8 2/20 0.39
ALOX5AP P20292 2/20 0.37
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
NLRP3 Q96P20 1/20 0.36
USP30 Q70CQ3 1/20 0.36
LIPE Q05469 4/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
PPARD Q03181 3/20 0.35
PPARG P37231 3/20 0.35

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
SCHEMBL12350647 0.83 PRMT5 (0.41) HIF1AAAK1USP30PRMT5WDR77
SCHEMBL4442924 0.82 ALOX5AP (0.41) ALOX5APPPARDPPARG
SCHEMBL8194015 0.78 USP30 (0.41) HIF1AAAK1USP30PRMT5WDR77
SCHEMBL1678552 0.71 NR1H2 (0.62) HIF1AAAK1
SCHEMBL14191741 0.71 RAB9A (0.41) HIF1ANPC1
SCHEMBL481893 0.71 USP30 (0.43) HIF1AAAK1USP30PRMT5WDR77
SCHEMBL27110645 0.71 USP30 (0.41) HIF1AAAK1USP30PRMT5WDR77
SCHEMBL150595 0.70 USP30 (0.41) HIF1AAAK1USP30PRMT5WDR77
SCHEMBL22724916 0.69 USP30 (0.40) HIF1AAAK1USP30PRMT5WDR77
SCHEMBL12172282 0.69 PRMT5 (0.43) HIF1AAAK1USP30PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124563-B1 BENZIMIDAZOLE TRPV1 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2015-07-29 EP disclosed
EP-2124563-A1 BENZIMIDAZOLE TRPV1 INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2009-12-02 EP disclosed
US-7612211-B2 Benzimidazole TRPV1 inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-03 US disclosed
US-7612211-B2 Benzimidazole TRPV1 inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-03 US disclosed
US-7612211-B2 Benzimidazole TRPV1 inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-03 US disclosed
WO-2008076752-A1 BENZIMIDAZOLE TRPV1 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-26 WO disclosed
US-20080146637-A1 BENZIMIDAZOLE TRPV1 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-19 US disclosed
US-20080146637-A1 BENZIMIDAZOLE TRPV1 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-19 US disclosed
US-20080146637-A1 BENZIMIDAZOLE TRPV1 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-19 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-20080146637-A1 BENZIMIDAZOLE TRPV1 INHIBITORS TRPV1, TRPV2, TRPA1 HIF1A 1292/4885AAK1 2021/4885ALOX5AP 571/4885

“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.