SCHEMBL24323069

SCHEMBL24323069

O=C(COc1ccc(Cl)c(F)c1)N[C@H]1CC2(C(=O)NCc3ccc(F)c(C(F)(F)F)c3)CC1C2

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 14/20 0.44
▸ P2RX7 Q99572 4/20 0.40
▸ PTPN7 P35236 1/20 0.38
▸ DUSP3 P51452 1/20 0.38
▸ TAOK1 Q7L7X3 1/20 0.38
▸ TAOK3 Q9H2K8 1/20 0.38

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
SCHEMBL24323038 0.90 ATF4 (0.48) ATF4TAOK1TAOK3
SCHEMBL24323037 0.88 ATF4 (0.45) ATF4
SCHEMBL24323279 0.87 ATF4 (0.47) ATF4
SCHEMBL24324277 0.87 ATF4 (0.43) ATF4
SCHEMBL24324526 0.86 ATF4 (0.45) ATF4P2RX7TAOK1TAOK3
SCHEMBL24324274 0.86 ATF4 (0.43) ATF4
SCHEMBL24323329 0.85 ATF4 (0.46) ATF4TAOK1TAOK3
SCHEMBL24323398 0.85 ATF4 (0.47) ATF4
SCHEMBL24322841 0.85 ATF4 (0.44) ATF4P2RX7TAOK1TAOK3
SCHEMBL24324152 0.85 ATF4 (0.45) ATF4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3452453-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2022-04-13 — — EP disclosed
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