SCHEMBL23973268

SCHEMBL23973268

O=c1[nH]c(C2(c3cncc(C(F)(F)F)c3)CC2)nc2c1CNCCC2

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 6/20 0.39
WNT3A P56704 5/20 0.39
TNKS O95271 5/20 0.39
PARP1 P09874 4/20 0.39
HTR6 P50406 1/20 0.33
PARP2 Q9UGN5 3/20 0.32
PARP14 Q460N5 1/20 0.32
PARP4 Q9UKK3 1/20 0.32
AXIN2 Q9Y2T1 1/20 0.32
PARP3 Q9Y6F1 1/20 0.32
TP53 P04637 1/20 0.32
PARP10 Q53GL7 1/20 0.31
PARP11 Q9NR21 1/20 0.31
MCHR1 Q99705 2/20 0.31
DAO P14920 1/20 0.30

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
SCHEMBL23973158 0.86 WNT3A (0.41) TNKS2WNT3ATNKSPARP1HTR6
SCHEMBL23972839 0.85 SPR (0.36)
SCHEMBL23972838 0.82 ALDH1A1 (0.32) TNKS2TNKS
SCHEMBL23973354 0.81 HTR2C (0.34) TNKS2TNKS
SCHEMBL23972847 0.81 HTR2A (0.30)
SCHEMBL23973357 0.79 CHEK1 (0.30)
SCHEMBL23973232 0.79 TNKS2 (0.46) TNKS2WNT3ATNKSPARP1PARP2
SCHEMBL23973218 0.78 TNKS2 (0.33) TNKS2WNT3ATNKS
SCHEMBL23972365 0.77 HPGD (0.38) TNKS2TNKSPARP1DAO
SCHEMBL23973163 0.76 HPGD (0.43) TNKS2WNT3ATNKSPARP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4142874-B1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC (JP) 2026-04-22 EP 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
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 1601/4885WNT3A 2816/4885TNKS 1079/4885

“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.