SCHEMBL22601464

SCHEMBL22601464

CC(C)(S)c1ccc(F)cn1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.39
GRM5 P41594 1/20 0.32
ALDH1A1 P00352 1/20 0.32
APLNR P35414 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
PDE10A Q9Y233 1/20 0.30
PTGS2 P35354 1/20 0.30
HSD11B1 P28845 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
SCHEMBL4729458 0.82 TRPV4 (0.37) TRPV4GRM5ALDH1A1APLNRGPR119
SCHEMBL17586504 0.80 TRPV4 (0.40) TRPV4GRM5ALDH1A1APLNRGPR119
SCHEMBL29649716 0.80 TRPV4 (0.40) TRPV4GRM5ALDH1A1APLNRGPR119
SCHEMBL16019424 0.78 TRPV4 (0.34) TRPV4GRM5ALDH1A1APLNRGPR119
SCHEMBL1507186 0.78 PDE10A (0.43) TRPV4APLNRPDE10APTGS2HSD11B1
SCHEMBL23262834 0.78 GRM5 (0.35) TRPV4GRM5ALDH1A1APLNRGPR119
SCHEMBL18463843 0.78 TRPV4 (0.34) TRPV4GRM5ALDH1A1APLNRGPR119
SCHEMBL16132531 0.78 HSD11B1 (0.37) TRPV4APLNRPDE10APTGS2HSD11B1
SCHEMBL2568687 0.75 GRM5 (0.33) TRPV4GRM5ALDH1A1APLNR
SCHEMBL22601556 0.75 CA12 (0.35) TRPV4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 HEPAGENE THERAPEUTICS, INC. (VG) 2020-10-29 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 (1 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-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 ATF1, ERN1, MAP3K1 TRPV4 4721/4885GRM5 4768/4885ALDH1A1 1908/4885

“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.