SCHEMBL21383897

SCHEMBL21383897

Cc1ccc(COc2cc(COS(C)(=O)=O)on2)cc1C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
NPC1 O15118 5/20 0.36
RAB9A P51151 5/20 0.36
TDP1 Q9NUW8 1/20 0.35
SMPD1 P17405 2/20 0.34
HSP90AA1 P07900 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL323763 0.83 SMPD1 (0.44) SMPD1
SCHEMBL19510957 0.82 NPC1 (0.41) POLBNPC1RAB9ATDP1
SCHEMBL21383849 0.80 NPC1 (0.35) POLBNPC1RAB9ATDP1SMPD1
SCHEMBL21383851 0.80 SMPD1 (0.40) POLBNPC1RAB9ATDP1SMPD1
SCHEMBL19511127 0.77 SMPD1 (0.38) POLBNPC1RAB9ATDP1SMPD1
SCHEMBL17122452 0.77 SMPD1 (0.43) SMPD1
SCHEMBL21383844 0.73 RAB9A (0.50) POLBNPC1RAB9ASMPD1HSP90AA1
SCHEMBL1941686 0.73 KMT2A (0.51) POLBNPC1RAB9ATDP1MEN1
SCHEMBL20668700 0.68 MRGPRX4 (0.40) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL21384116 0.67 NPC1 (0.33) NPC1RAB9ATDP1SMPD1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357347-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. 2023-11-09 US disclosed
US-11535660-B1 Modulators of G-protein coupled receptors Cannot Therapeutics, Inc. (US) 2022-12-27 US disclosed
EP-3768294-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS Carmot Therapeutics, Inc. (US) 2021-01-27 EP disclosed
WO-2019183577-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. (US) 2019-09-26 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 (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-20230357347-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS GIPR, GLP1R, GCGR POLB 4729/4885NPC1 1890/4885RAB9A 664/4885
US-11535660-B1 Modulators of G-protein coupled receptors GIPR, GLP1R, GCGR POLB 4782/4885NPC1 1936/4885RAB9A 616/4885

“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.