SCHEMBL23973232

SCHEMBL23973232

O=c1[nH]c(C2(c3ccc(C(F)(F)F)cc3)CC2)nc2c1CNCC2

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 8/20 0.46
TNKS O95271 7/20 0.46
WNT3A P56704 5/20 0.46
PARP1 P09874 5/20 0.46
PARP2 Q9UGN5 4/20 0.42
PARP14 Q460N5 1/20 0.42
PARP4 Q9UKK3 1/20 0.42
AXIN2 Q9Y2T1 1/20 0.42
PARP3 Q9Y6F1 1/20 0.42
DAO P14920 1/20 0.42
HTR2C P28335 4/20 0.37
HTR2B P41595 3/20 0.37
HTR2A P28223 2/20 0.35
MCHR1 Q99705 2/20 0.35
DGAT2 Q96PD7 1/20 0.35
BRD4 O60885 1/20 0.34
PDE2A O00408 1/20 0.33
CLPP Q16740 1/20 0.33

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
SCHEMBL23973234 0.87 HTR2C (0.41) TNKS2TNKSPARP1DAOHTR2C
SCHEMBL23973236 0.85 TNKS2 (0.39) TNKS2TNKSWNT3APARP1HTR2C
SCHEMBL23973233 0.85 TNKS2 (0.39) TNKS2TNKSWNT3APARP1HTR2C
SCHEMBL23973237 0.85 HTR2C (0.40) TNKS2TNKSWNT3APARP1HTR2C
SCHEMBL23972481 0.84 HTR2C (0.44) TNKS2TNKSPARP1DAOHTR2C
SCHEMBL23973342 0.83 HTR2C (0.42) TNKS2TNKSPARP1HTR2CHTR2B
SCHEMBL23972276 0.83 TP53 (0.40) TNKS2TNKSPARP1PARP2HTR2C
SCHEMBL23973231 0.82 TNKS (0.36) TNKS2TNKSPARP1HTR2CHTR2B
SCHEMBL30284329 0.82 TNKS (0.36) TNKS2TNKSPARP1HTR2CHTR2B
SCHEMBL23973235 0.80 PARP1 (0.36) TNKS2TNKSPARP1HTR2CHTR2B

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-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN claimed
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN disclosed
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
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US 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-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 TNKS2 1601/4885TNKS 1079/4885WNT3A 2816/4885

“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.