SCHEMBL23972720

SCHEMBL23972720

Cc1cccc(C(O)C(=O)N2CCc3nc(C4(c5ccc(Cl)cc5)CC4)[nH]c(=O)c3C2)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MTHFD2 P13995 5/20 0.37
▸ ROCK2 O75116 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ PRLHR P49683 9/20 0.34
▸ CLPP Q16740 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ RXFP1 Q9HBX9 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
SCHEMBL30283970 1.00 MTHFD2 (0.37) MTHFD2ROCK2CYP3A4MAPTPRLHR
SCHEMBL25363775 0.93 ROCK2 (0.42) MTHFD2ROCK2CYP3A4MAPTPRLHR
SCHEMBL23973811 0.93 ROCK2 (0.42) MTHFD2ROCK2CYP3A4MAPTPRLHR
SCHEMBL23972726 0.93 MTHFD2 (0.41) MTHFD2ROCK2CYP3A4MAPTCLPP
SCHEMBL30283932 0.93 MTHFD2 (0.41) MTHFD2ROCK2CYP3A4MAPTCLPP
SCHEMBL30283762 0.92 THRB (0.37) MTHFD2MAPTCLPP
SCHEMBL23973030 0.92 THRB (0.37) MTHFD2MAPTCLPP
SCHEMBL23973803 0.92 ROCK2 (0.40) MTHFD2ROCK2CYP3A4MAPTCLPP
SCHEMBL23972479 0.88 MTHFD2 (0.42) MTHFD2CLPP
SCHEMBL30284344 0.88 MTHFD2 (0.42) MTHFD2CLPP

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-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 — — US disclosed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 — — US disclosed
CN-115427409-A Pyrimidin-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2022-12-02 — — CN disclosed
WO-2021221169-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2021-11-04 — — 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-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS TRPV4, TRPV1, TRPV2 MTHFD2 2762/4885ROCK2 3909/4885CYP3A4 978/4885

“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.

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