SCHEMBL23973269

SCHEMBL23973269

O=c1[nH]c(C2(c3cccc(OCc4ccccc4)c3)CC2)nc2c1CNCCC2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.42
CYP3A4 P08684 1/20 0.38
BRD4 O60885 1/20 0.38
ALOX5 P09917 1/20 0.37
HTR1A P08908 1/20 0.37
DRD1 P21728 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
HTR6 P50406 1/20 0.37
HPD P32754 1/20 0.36
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
DPYD Q12882 1/20 0.36

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
SCHEMBL23973264 0.88 SMN1; SMN2 (0.38) HTR2A
SCHEMBL23973165 0.85 TNKS2 (0.44) BRD4
SCHEMBL23972779 0.84 HTR2C (0.43) MCHR1CYP3A4
SCHEMBL26669232 0.84 HTR2C (0.40) MCHR1CYP3A4
SCHEMBL23972365 0.83 HPGD (0.38) HTR2A
SCHEMBL23973335 0.83 TNKS2 (0.38) HTR6
SCHEMBL23973277 0.83 TSHR (0.35) HTR2A
SCHEMBL23973211 0.82 TNKS (0.39) HTR2AHTR6MAOAMAOB
SCHEMBL23973166 0.80 SPR (0.41) BRD4
SCHEMBL23973163 0.80 HPGD (0.43) HTR2A

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 MCHR1 693/4885CYP3A4 978/4885BRD4 358/4885

“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.