SCHEMBL30580183

SCHEMBL30580183

N#Cc1cccc(CNC(=O)NC23CC(C(F)(F)F)(C2)C3)c1F

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 14/20 0.35
▸ CFD P00746 1/20 0.34
▸ GRIN1 Q05586 1/20 0.33
▸ GRIN2A Q12879 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ PDK2 Q15119 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ EPHX2 P34913 1/20 0.31

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
SCHEMBL25370780 1.00 P2RX7 (0.35) P2RX7CFDGRIN1GRIN2AALDH1A1
SCHEMBL26051687 0.81 EPHX2 (0.36) P2RX7CFDALDH1A1CYP11B1CYP11B2
SCHEMBL30580204 0.80 CYP3A4 (0.40) EPHX2
SCHEMBL25370529 0.80 CYP3A4 (0.40) EPHX2
SCHEMBL26050994 0.78 P2RX7 (0.35) P2RX7CFDGRIN1GRIN2AEPHX2
SCHEMBL28803365 0.76 CFD (0.39) P2RX7CFDGRIN1GRIN2AALDH1A1
SCHEMBL25369595 0.76 ERCC1 (0.46) MAPK1EPHX2
SCHEMBL30580137 0.76 ERCC1 (0.46) MAPK1EPHX2
SCHEMBL26051685 0.74 ALDH1A1 (0.36) P2RX7CFDGRIN1GRIN2AALDH1A1
SCHEMBL25372012 0.71 TRPA1 (0.39) PDK2

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
US-20250002452-A1 BICYCLOPENTANE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2025-01-02 — — US claimed
US-20250002452-A1 BICYCLOPENTANE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2025-01-02 — — US disclosed
EP-4479377-A1 NEW BICYCLOPENTANE DERIVATIVES Icagen, LLC (US) 2024-12-25 — — EP disclosed
CN-118829626-A Novel dicyclopentane derivatives 伊卡根有限责任公司 2024-10-22 — — CN disclosed
WO-2023158584-A1 NEW BICYCLOPENTANE DERIVATIVES ICAGEN, LLC (US) 2023-08-24 — — 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-20250002452-A1 BICYCLOPENTANE DERIVATIVES BICRA, C1R, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 P2RX7 1289/4885CFD 890/4885GRIN1 2140/4885

“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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