SCHEMBL20003505

SCHEMBL20003505

C=C1CN(S(=O)(=O)c2ccc(C#N)cc2Cl)C[C@H]1O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 19/20 0.53
CYP3A4 P08684 1/20 0.48
KCNH2 Q12809 1/20 0.48
CYP19A1 P11511 1/20 0.46

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
SCHEMBL30014547 1.00 TRPV4 (0.53) TRPV4CYP3A4KCNH2CYP19A1
SCHEMBL21171930 0.85 TRPV4 (0.48) TRPV4
SCHEMBL23141089 0.83 TRPV4 (0.48) TRPV4CYP3A4KCNH2CYP19A1
SCHEMBL30014377 0.83 TRPV4 (0.48) TRPV4CYP3A4KCNH2CYP19A1
SCHEMBL21144246 0.82 TRPV4 (0.51) TRPV4
SCHEMBL21144245 0.82 TRPV4 (0.51) TRPV4
SCHEMBL29355694 0.82 TRPV4 (0.51) TRPV4
SCHEMBL30014857 0.81 TRPV4 (0.45) TRPV4CYP3A4KCNH2CYP19A1
SCHEMBL21144185 0.79 TRPV4 (0.50) TRPV4
SCHEMBL21144183 0.79 TRPV4 (0.50) 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 4 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-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
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 (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-20210299113-A1 TRPV4 ANTAGONISTS TRPV4, TRPV5, TRPV2 TRPV4 1/4885CYP3A4 1185/4885KCNH2 305/4885

“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.