SCHEMBL6845679

SCHEMBL6845679

COc1ccc(-c2nc3ccc(S(C)(=O)=O)cc3c(C(=O)NC3(c4ccccc4)CC3)c2CN2CCC(N3CCCC3)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 16/20 0.65
TACR3 P29371 5/20 0.48
TACR2 P21452 4/20 0.48
OPRM1 P35372 2/20 0.48
KCNH2 Q12809 1/20 0.43

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
SCHEMBL30283698 1.00 TRPV4 (0.65) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL6845610 0.99 TRPV4 (0.66) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL6845543 0.94 TRPV4 (0.58) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL30284145 0.94 TRPV4 (0.58) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL6845695 0.90 TRPV4 (0.69) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL30284017 0.90 TRPV4 (0.69) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL6845697 0.89 TRPV4 (0.71) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL2373423 0.89 TRPV4 (0.61) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL6845594 0.89 TRPV4 (0.62) TRPV4TACR3TACR2OPRM1KCNH2
SCHEMBL25192865 0.88 TRPV4 (0.67) TRPV4TACR3TACR2OPRM1KCNH2

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-20230255965-A1 TRPV4 INHIBITOR AS A THERAPEUTIC AGENT FOR OCULAR DISEASES RAQUALIA PHARMA INC. (JP) 2023-08-17 US disclosed
EP-4183415-A1 TRPV4 INHIBITOR AS THERAPEUTIC DRUG FOR EYE DISEASE RaQualia Pharma Inc. (JP) 2023-05-24 EP disclosed
CN-115776890-A TRPV4 inhibitors as therapeutic agents for eye diseases 拉夸里亚创药株式会社 2023-03-10 CN disclosed
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 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-20230255965-A1 TRPV4 INHIBITOR AS A THERAPEUTIC AGENT FOR OCULAR DISEASES TRPV4, TRPV5, TRPV2 TRPV4 1/4885TACR3 885/4885TACR2 314/4885

“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.