SCHEMBL13741013

SCHEMBL13741013

CC(C)C1(O)CCC(O)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
HSD11B1 P28845 1/20 0.32
TSHR P16473 1/20 0.32
SHBG P04278 1/20 0.31
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL16840149 1.00 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL16750086 1.00 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL8084874 0.79 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL21141618 0.79 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL26685213 0.77 OPRM1 (0.32) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL10126912 0.77 OPRL1 (0.32) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL13011356 0.77 OPRM1 (0.32) OPRM1OPRD1OPRK1OPRL1HSD11B1
SCHEMBL130746 0.76
SCHEMBL12727653 0.76 TSHR (0.33) TSHRSHBGSLC6A4SLC6A3
Hydrochloric Acid SCHEMBL282226 0.75 OPRL1 (0.32) OPRM1OPRD1OPRK1OPRL1HSD11B1

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
US-20240158392-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES JANSSEN RESEARCH & DEVELOPMENT, LLC 2024-05-16 US disclosed
EP-4284801-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES Janssen Biotech, Inc. (US) 2023-12-06 EP disclosed
WO-2022165529-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES JANSSEN BIOTECH, INC. (US) 2022-08-04 WO disclosed
US-9376418-B2 Substituted pyridine spleen tyrosine kinase (SYK) inhibitors MERCK SHARP & DOHME CORP. (US) 2016-06-28 US disclosed
US-20150148327-A1 SUBSTITUTED PYRIDINE SPLEEN TYROSINE KINASE (SYK) INHIBITORS MERCK CANADA INC. (CA) 2015-05-28 US disclosed
US-20090215766-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES INCYTE CORPORATION 2009-08-27 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 (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-20090215766-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES JAK1, JAK2, JAK3 OPRM1 4370/4885OPRD1 4500/4885OPRK1 3125/4885
US-20240158392-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES SIK2, SIK1, SGK2 OPRM1 4373/4885OPRD1 4447/4885OPRK1 1317/4885
US-20150148327-A1 SUBSTITUTED PYRIDINE SPLEEN TYROSINE KINASE (SYK) INHIBITORS SYK, BTK, LYN OPRM1 4468/4885OPRD1 4332/4885OPRK1 2343/4885

“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.