SCHEMBL17264875

SCHEMBL17264875

CC(C)(C)[C@H]1COCCO1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM3 P20309 1/20 0.37

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
SCHEMBL9868926 1.00 CHRM2 (0.37) CHRM2CHRM4CHRM5CHRM3
SCHEMBL17264874 1.00 CHRM2 (0.37) CHRM2CHRM4CHRM5CHRM3
SCHEMBL8281878 0.97 CHRM2 (0.35) CHRM2CHRM4CHRM5CHRM3
SCHEMBL8281881 0.97 CHRM2 (0.35) CHRM2CHRM4CHRM5CHRM3
SCHEMBL8281880 0.97 CHRM2 (0.35) CHRM2CHRM4CHRM5CHRM3
SCHEMBL9004334 0.79 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM3
SCHEMBL27431188 0.79 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM3
SCHEMBL30896282 0.79 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM3
SCHEMBL159311 0.78
SCHEMBL11188215 0.78

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
US-20230301970-A1 CARBOXAMIDE DERIVATIVES NOVARTIS PHARMACEUTICALS UK LIMITED (GB) 2023-09-28 US disclosed
US-11672782-B2 Carboxamide derivatives NOVARTIS AG (CH) 2023-06-13 US disclosed
US-20220002290-A1 TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-01-06 US disclosed
US-10195181-B2 Carboxamide derivatives NOVARTIS AG (CH) 2019-02-05 US disclosed
US-20180222895-A1 COMPOUNDS FOR USE IN PREPARING HETEROCYCLIC TRIAZOLE AGONISTS OF THE APJ RECEPTOR AMGEN INC. 2018-08-09 US disclosed
US-20180222895-A1 COMPOUNDS FOR USE IN PREPARING HETEROCYCLIC TRIAZOLE AGONISTS OF THE APJ RECEPTOR AMGEN INC. 2018-08-09 US disclosed
US-9988369-B2 Heterocyclic triazole compounds as agonists of the APJ receptor AMGEN INC. (US) 2018-06-05 US disclosed
US-20170320860-A1 HETEROCYCLIC TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. 2017-11-09 US disclosed
US-20170014388-A1 CARBOXAMIDE DERIVATIVES NOVARTIS AG (CH) 2017-01-19 US disclosed
US-20170014388-A1 CARBOXAMIDE DERIVATIVES NOVARTIS AG (CH) 2017-01-19 US disclosed
US-9403810-B2 Carboxamide derivatives NOVARTIS AG (CH) 2016-08-02 US disclosed
US-20150329529-A1 CARBOXAMIDE DERIVATIVES NOVARTIS AG (CH) 2015-11-19 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 (8 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-20220002290-A1 TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR BCL2L11, BCL2, BCL2L2 CHRM2 4881/4885CHRM4 4885/4885CHRM5 4884/4885
US-20230301970-A1 CARBOXAMIDE DERIVATIVES SIRT1, ADCY5, ASIC1 CHRM2 818/4885CHRM4 892/4885CHRM5 468/4885
US-20180222895-A1 COMPOUNDS FOR USE IN PREPARING HETEROCYCLIC TRIAZOLE AGONISTS OF THE APJ RECEPTOR TBXA2R, APLNR, GPR27 CHRM2 1150/4885CHRM4 919/4885CHRM5 720/4885
US-20150329529-A1 CARBOXAMIDE DERIVATIVES SIRT5, SIRT7, ADCY5 CHRM2 898/4885CHRM4 883/4885CHRM5 374/4885
US-11672782-B2 Carboxamide derivatives SIRT5, SIRT7, ADCY5 CHRM2 898/4885CHRM4 883/4885CHRM5 374/4885
US-20170014388-A1 CARBOXAMIDE DERIVATIVES SIRT5, SIRT7, ADCY5 CHRM2 898/4885CHRM4 883/4885CHRM5 374/4885
US-20170320860-A1 HETEROCYCLIC TRIAZOLE COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR TBXA2R, APLNR, AGTR1 CHRM2 1137/4885CHRM4 1367/4885CHRM5 1006/4885
US-10195181-B2 Carboxamide derivatives SIRT5, SIRT7, ADCY5 CHRM2 898/4885CHRM4 883/4885CHRM5 374/4885

“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.