SCHEMBL30284033

SCHEMBL30284033

O=C([C@H](O)c1cccc(Cl)c1)N1CCCc2nc(C3(c4cccc(Cl)c4)CC3)[nH]c(=O)c2C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 3/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ HPGD P15428 1/20 0.36
▸ TNKS O95271 7/20 0.35
▸ TNKS2 Q9H2K2 7/20 0.35
▸ MTHFD2 P13995 3/20 0.35
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ FABP4 P15090 1/20 0.34
▸ CLPP Q16740 1/20 0.33
▸ IDO1 P14902 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
SCHEMBL23973585 1.00 ROCK2 (0.41) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL28933154 1.00 ROCK2 (0.41) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL23973764 0.96 ROCK2 (0.41) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL23972565 0.95 ROCK2 (0.37) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL31406781 0.95 ROCK2 (0.37) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL28933100 0.95 ROCK2 (0.37) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL23972876 0.95 ROCK2 (0.39) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL23973646 0.95 ROCK2 (0.37) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL30284256 0.95 ROCK2 (0.39) ROCK2CYP3A4HPGDTNKSTNKS2
SCHEMBL30284146 0.95 ROCK2 (0.37) ROCK2CYP3A4HPGDTNKSTNKS2

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
EP-4142874-B1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC (JP) 2026-04-22 — — EP 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 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
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
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