SCHEMBL20003543

SCHEMBL20003543

N#Cc1ccc(S(=O)(=O)Cl)c(OC2CC2)c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 8/20 0.63
HRH3 Q9Y5N1 2/20 0.36
ALK Q9UM73 1/20 0.36
PGR P06401 1/20 0.36
EPAS1 Q99814 2/20 0.35
SLC6A9 P48067 3/20 0.35
EPHX2 P34913 1/20 0.34
GPR119 Q8TDV5 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
SCHEMBL19682479 0.78 TRPV4 (0.70) TRPV4
SCHEMBL23140910 0.78 TRPV4 (1.00) TRPV4SLC6A9
SCHEMBL29420303 0.78 TRPV4 (1.00) TRPV4SLC6A9
SCHEMBL1082080 0.75 TRPV4 (0.61) TRPV4PGREPAS1
SCHEMBL1080669 0.74 TRPV4 (0.53) TRPV4PGR
SCHEMBL29825320 0.72 MAP3K5 (0.42) SLC6A9EPHX2GPR119
SCHEMBL23287020 0.72 MAP3K5 (0.42) SLC6A9EPHX2GPR119
SCHEMBL7765655 0.71 TRPV4 (0.60) TRPV4
SCHEMBL1020883 0.71 TRPV4 (0.60) TRPV4
SCHEMBL29948706 0.71 TRPV4 (0.60) TRPV4

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
CN-109790116-B TRPV4 antagonists 葛兰素史密斯克莱知识产权(第2 号)有限公司 2022-10-28 CN disclosed
US-11260049-B2 TRPV4 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2022-03-01 US disclosed
US-20210299113-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2021-09-30 US disclosed
US-20210299113-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2021-09-30 US disclosed
EP-3515888-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2021-03-31 EP disclosed
EP-3515888-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2021-03-31 EP disclosed
WO-2018055526-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 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-11260049-B2 TRPV4 antagonists TRPV4, TRPV5, TRPV2 TRPV4 1/4885HRH3 933/4885ALK 1756/4885
US-20210299113-A1 TRPV4 ANTAGONISTS TRPV4, TRPV5, TRPV2 TRPV4 1/4885HRH3 933/4885ALK 1756/4885

“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.