SCHEMBL23406491

SCHEMBL23406491

CC(C)(C)OC(=O)N1CC[C@@H]2C(=O)CC[C@@H]21

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.41
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
GRM5 P41594 3/20 0.37
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
HPGD P15428 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
SCHEMBL23406490 1.00 HSD11B1 (0.41) HSD11B1HSD17B10KDM4EMAPTTHRB
SCHEMBL5938275 1.00 HSD11B1 (0.41) HSD11B1HSD17B10KDM4EMAPTTHRB
SCHEMBL1691937 0.93 HSD11B1 (0.40) HSD11B1HSD17B10CHRM2CHRM1CHRM3
SCHEMBL1691897 0.93 HSD11B1 (0.40) HSD11B1HSD17B10CHRM2CHRM1CHRM3
SCHEMBL5937784 0.91 HSD11B1 (0.48) HSD11B1HSD17B10
SCHEMBL30959549 0.88 NPC1 (0.40) HSD17B10KDM4EMAPTTHRBGRM5
SCHEMBL5938471 0.88 NPC1 (0.40) HSD17B10KDM4EMAPTTHRBGRM5
SCHEMBL15245630 0.87 HSD11B1 (0.42) HSD11B1HSD17B10HPGD
SCHEMBL5939603 0.86 CHRM2 (0.41) HSD11B1HSD17B10KDM4EMAPTTHRB
SCHEMBL5938430 0.85 HSD11B1 (0.46) HSD11B1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3810615-B1 ARGINASE INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2026-01-28 EP disclosed
US-11274111-B2 Arginase inhibitors and methods of use MERCK SHARP & DOHME CORP. (US) 2022-03-15 US disclosed
US-20210163505-A1 ARGINASE INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME CORP. (US) 2021-06-03 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 (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-20210163505-A1 ARGINASE INHIBITORS AND METHODS OF USE ARG1, ARG2, PRMT1 HSD11B1 403/4885HSD17B10 1343/4885KDM4E 3146/4885
US-11274111-B2 Arginase inhibitors and methods of use ARG1, ARG2, PRMT1 HSD11B1 403/4885HSD17B10 1343/4885KDM4E 3146/4885

“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.