SCHEMBL19658258

SCHEMBL19658258

CC(C)(C)OC(=O)N1CC[C@@H](C(=O)ON2C(=O)CCC2=O)C[C@H]1C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CHRM2 P08172 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ UCHL1 P09936 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ RECQL P46063 1/20 0.34
▸ PTPN2 P17706 1/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ PTPN6 P29350 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ATM Q13315 2/20 0.34
▸ KLK7 P49862 1/20 0.34

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
SCHEMBL21049847 1.00 HSD17B10 (0.42) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL19658381 1.00 HSD17B10 (0.42) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL9893215 0.84 HSD17B10 (0.50) HSD17B10SMN1; SMN2HPGDNPC1UCHL1
SCHEMBL4959104 0.84 HSD17B10 (0.50) HSD17B10SMN1; SMN2HPGDNPC1UCHL1
SCHEMBL357242 0.84 HSD17B10 (0.50) HSD17B10SMN1; SMN2HPGDNPC1UCHL1
SCHEMBL10347006 0.82 HSD17B10 (0.46) HSD17B10SMN1; SMN2HPGDNPC1UCHL1
SCHEMBL5494939 0.81 HPGD (0.52) HPGDNPC1RAB9ARECQLPTPN2
SCHEMBL26464539 0.80 CYP1A2 (0.47) HSD17B10CHRM2CHRM1CHRM3ATM
SCHEMBL26464715 0.80 CYP1A2 (0.47) HSD17B10CHRM2CHRM1CHRM3ATM
SCHEMBL26464816 0.80 CYP1A2 (0.47) HSD17B10CHRM2CHRM1CHRM3ATM

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-20230310551-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME LLC (US) 2023-10-05 — — US disclosed
US-20230310551-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME LLC (US) 2023-10-05 — — US disclosed
US-10689430-B2 Insulin receptor partial agonists MERCK SHARP & DOHME CORP. (US) 2020-06-23 — — US disclosed
US-10689430-B2 Insulin receptor partial agonists MERCK SHARP & DOHME CORP. (US) 2020-06-23 — — US disclosed
US-20190177393-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME CORP. (US) 2019-06-13 — — US disclosed
US-20190177393-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME CORP. (US) 2019-06-13 — — US disclosed
WO-2017205309-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME CORP. (US) 2017-11-30 — — 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 (3 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-20190177393-A1 INSULIN RECEPTOR PARTIAL AGONISTS INSR, GPR119, IRS1 HSD17B10 2172/4885SMN1; SMN2 3416/4885CHRM2 954/4885
US-10689430-B2 Insulin receptor partial agonists INSR, GPR119, IRS1 HSD17B10 2172/4885SMN1; SMN2 3416/4885CHRM2 954/4885
US-20230310551-A1 INSULIN RECEPTOR PARTIAL AGONISTS INSR, GPR119, IRS1 HSD17B10 2172/4885SMN1; SMN2 3416/4885CHRM2 954/4885

“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.

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