SCHEMBL186630

SCHEMBL186630

CC(=O)N(C(=O)OC(C)(C)C)C(C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
MTOR P42345 1/20 0.42
CTSK P43235 3/20 0.38
RIPK1 Q13546 2/20 0.38
CTSS P25774 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL2715266 1.00 ALOX5 (0.42) ALOX5MTORCTSKRIPK1CTSS
SCHEMBL3897727 1.00 ALOX5 (0.42) ALOX5MTORCTSKRIPK1CTSS
SCHEMBL2953235 0.83 PTGS2 (0.47) ALOX5CTSKCTSS
SCHEMBL21798473 0.82 MTOR (0.53) ALOX5MTORCTSKRIPK1CTSS
SCHEMBL30034373 0.82 MTOR (0.53) ALOX5MTORCTSKRIPK1CTSS
SCHEMBL16914053 0.81 ALOX5 (0.57) ALOX5MTOR
SCHEMBL6672642 0.80 AKT1 (0.42) CTSKRIPK1CTSSALDH1A1TSHR
SCHEMBL6613322 0.79 ALOX5 (0.47) ALOX5MTORCTSKRIPK1CTSS
SCHEMBL118082 0.79 ALOX5 (0.47) ALOX5MTORCTSKRIPK1CTSS
SCHEMBL17241382 0.78 MAPT (0.38) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1735286-B1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2012-01-04 EP disclosed
US-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS LAGU BHARAT 2009-04-16 US disclosed
US-7452997-B2 Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2008-11-18 US disclosed
EP-1735286-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-27 EP disclosed
US-20050228034-A1 Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-13 US disclosed
WO-2005095353-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-13 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-20050228034-A1 Tetrahydro-indazole cannabinoid modulators CNR2, CNR1, GPR18 ALOX5 303/4885MTOR 542/4885CTSK 2792/4885
US-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS CNR2, CNR1, GPR18 ALOX5 303/4885MTOR 542/4885CTSK 2792/4885

“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.