SCHEMBL23973285

SCHEMBL23973285

CC(C)(C)OC(=O)N1CCCc2nc(C3(c4cccc(C5=CCCCC5)c4)CC3)[nH]c(=O)c2C1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SPR P35270 5/20 0.36
RORC P51449 1/20 0.36
PARP1 P09874 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
MTHFD2 P13995 3/20 0.35
F12 P00748 2/20 0.34
MGAT2 Q10469 1/20 0.33
C5AR1 P21730 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
PDE10A Q9Y233 1/20 0.33
AVPR1A P37288 1/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32

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
SCHEMBL23973281 0.96 F12 (0.37) SPRRORCPARP1TNKS2PARP2
SCHEMBL23972345 0.90 CYP11B2 (0.38) SPRRORCPARP1TNKS2PARP2
SCHEMBL23973045 0.85 SPR (0.39) SPRRORCPARP1TNKS2PARP2
SCHEMBL23973046 0.85 SPR (0.39) SPRPARP1TNKS2PARP2F12
SCHEMBL23973047 0.85 SPR (0.39) SPRPARP1TNKS2PARP2F12
SCHEMBL23972349 0.85 SPR (0.36) SPRRORCPARP1TNKS2PARP2
SCHEMBL23973274 0.85 SPR (0.42) SPRPARP1TNKS2PARP2MTHFD2
SCHEMBL23972824 0.84 DGAT2 (0.44) SPRPARP1TNKS2PARP2MGAT2
SCHEMBL23973303 0.84 MTHFD2 (0.44) PARP1TNKS2PARP2MTHFD2F12
SCHEMBL31407016 0.84 SPR (0.35) SPRPARP1TNKS2PARP2MTHFD2

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
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 SPR 840/4885RORC 563/4885PARP1 2542/4885

“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.