SCHEMBL30686535

SCHEMBL30686535

CC1(C)CN(C2CCCC2)c2cccnc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.35
▸ OPRL1 P41146 2/20 0.35
▸ OPRM1 P35372 2/20 0.35
▸ OPRD1 P41143 2/20 0.35
▸ PIK3CA P42336 2/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ GFER P55789 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ MYC P01106 1/20 0.32
▸ DRD4 P21917 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ OGFRL1 Q5TC84 1/20 0.32
▸ AKT1 P31749 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MARK3 P27448 1/20 0.31
▸ MARK4 Q96L34 1/20 0.31
▸ IDH1 O75874 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
SCHEMBL30686583 0.86 P2RX7 (0.34) OPRM1PIK3CAHSD11B1
SCHEMBL31700179 0.84 CYP11B2 (0.39) ALDH1A1PIK3CAPDE4A
SCHEMBL31079849 0.81 MAP4K1 (0.34) OPRL1OPRM1PIK3CA
SCHEMBL29913465 0.80 CHRM2 (0.47) OPRL1OPRM1DRD4OPRK1
SCHEMBL29913676 0.77 KDM4E (0.45) DRD4AKT1
SCHEMBL31368984 0.76 JAK2 (0.33) —
SCHEMBL29913506 0.76 HTR3E (0.39) MEN1KMT2AHSD11B1GAAAKT1
SCHEMBL31368936 0.75 HTR2A (0.30) —
SCHEMBL29913679 0.75 CHRM2 (0.50) ALDH1A1MEN1KMT2ADRD4
SCHEMBL22415720 0.74 NISCH (0.35) ALDH1A1PIK3CAGAAMYC

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-20250320224-A1 NOVEL PAR-2 INHIBITORS DOMAIN THERAPEUTICS (FR) 2025-10-16 — — US disclosed
EP-4532496-A1 NOVEL PAR-2 INHIBITORS Domain Therapeutics (FR) 2025-04-09 — — EP disclosed
CN-119384420-A Novel PAR-2 inhibitors 多曼治疗学公司 2025-01-28 — — CN disclosed
WO-2023233033-A1 NOVEL PAR-2 INHIBITORS DOMAIN THERAPEUTICS (FR) 2023-12-07 — — 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-20250320224-A1 NOVEL PAR-2 INHIBITORS F2RL1, F2R, F2RL3 ALDH1A1 1534/4885OPRL1 284/4885OPRM1 1391/4885

“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.

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