SCHEMBL893519

SCHEMBL893519

CC(C)(C)OC(=O)N(N)Cc1ccc(-c2ccccn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.41
UGT1A1 P22309 2/20 0.41
MLNR O43193 1/20 0.41
NR1I2 O75469 1/20 0.41
SLCO2B1 O94956 1/20 0.41
ABCB11 O95342 1/20 0.41
ABCB1 P08183 1/20 0.41
CCKAR P32238 1/20 0.41
OPRK1 P41145 1/20 0.41
GHSR Q92847 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA5A P35218 4/20 0.40
CA9 Q16790 4/20 0.40

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
SCHEMBL7920836 0.83 TAAR1 (0.45)
SCHEMBL20163085 0.81 TRPV1 (0.43) TRPV1ABL1BCRNR1H2CYP1A2
SCHEMBL2061999 0.80 AKT1 (0.50) CA12CA1CA9
SCHEMBL6172063 0.80 UGT1A1 (0.42) TRPV1UGT1A1MLNRNR1I2SLCO2B1
SCHEMBL7326927 0.79 CYP1A2 (0.45) CYP1A2POLB
SCHEMBL4421307 0.78 DPP4 (0.44) TRPV1UGT1A1MLNRNR1I2SLCO2B1
SCHEMBL8336083 0.77 CYP17A1 (0.44) CYP19A1
SCHEMBL6472741 0.77 CYP1A2 (0.44) TRPV1ABL1BCRCYP1A2CYP2D6
SCHEMBL3697349 0.76 PPARG (0.44) TRPV1UGT1A1MLNRNR1I2SLCO2B1
SCHEMBL30608878 0.76 AKT1 (0.52) TRPV1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116987024-A Preparation method of atazanavir intermediate 浙江荣耀生物科技股份有限公司 2023-11-03 CN claimed
CN-116987024-B Atazanavir preparation Process for the preparation of intermediates 浙江荣耀生物科技股份有限公司 2026-02-13 CN disclosed
CN-116987024-A Preparation method of atazanavir intermediate 浙江荣耀生物科技股份有限公司 2023-11-03 CN disclosed
US-20140243340-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBVIE INC. (US) 2014-08-28 US disclosed
US-20130131085-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2013-05-23 US disclosed
US-20120309762-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2012-12-06 US disclosed
EP-2465856-A2 Cytochrome P450 oxidase inhibitors and uses thereof Abbott Laboratories (US) 2012-06-20 EP disclosed
EP-2465855-A1 Cytochrome P450 oxidase inhibitors and uses thereof Abbott Laboratories (US) 2012-06-20 EP disclosed
US-20120083490-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2012-04-05 US disclosed
EP-2081917-A2 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF Abbott Laboratories (US) 2009-07-29 EP disclosed
US-20080161246-A1 Improving the pharmacokinetics of drugs such as antiviral agents that are metabolized by CYP enzymes; N-heterocyclic compounds containing carbamate group, where is excluded; 1,3-thiazol-5-ylmethyl 1,1-dibenzylbut-3-enylcarbamate for example ABBOTT LABORATORIES (US) 2008-07-03 US disclosed
WO-2008027932-A2 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2008-03-06 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 (5 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-20120083490-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF CYP3A43, CYP3A5, POR TRPV1 1816/4885UGT1A1 35/4885MLNR 1233/4885
US-20080161246-A1 Improving the pharmacokinetics of drugs such as antiviral agents that are metabolized by CYP enzymes; N-heterocyclic compounds containing carbamate group, where is excluded; 1,3-thiazol-5-ylmethyl 1,1-dibenzylbut-3-enylcarbamate for example CYP3A4, CYP3A5, CYP2B6 TRPV1 2832/4885UGT1A1 27/4885MLNR 1424/4885
US-20120309762-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF CYP3A43, CYP3A5, POR TRPV1 1816/4885UGT1A1 35/4885MLNR 1233/4885
US-20130131085-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF CYP3A43, CYP3A5, POR TRPV1 1816/4885UGT1A1 35/4885MLNR 1233/4885
US-20140243340-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF CYP3A43, CYP3A5, POR TRPV1 1816/4885UGT1A1 35/4885MLNR 1233/4885

“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.