SCHEMBL30445745

SCHEMBL30445745

Cc1ccc(C)c(CNC(=O)C23CC(NC(=O)COc4ccc(Cl)c(F)c4)(C2)C3)c1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 18/20 0.54
▸ ALDH1A1 P00352 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 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
SCHEMBL21116443 1.00 ATF4 (0.54) ATF4ALDH1A1NPC1RAB9A
SCHEMBL19577323 0.94 ATF4 (0.55) ATF4
SCHEMBL19577485 0.90 ATF4 (0.55) ATF4ALDH1A1
SCHEMBL21116608 0.87 ATF4 (0.51) ATF4ALDH1A1
SCHEMBL19577409 0.86 ATF4 (0.54) ATF4RAB9A
SCHEMBL19577336 0.86 ATF4 (0.54) ATF4
SCHEMBL22661772 0.86 ATF4 (0.54) ATF4
SCHEMBL30446961 0.86 ATF4 (0.54) ATF4RAB9A
SCHEMBL30445454 0.86 ATF4 (0.54) ATF4
SCHEMBL19577434 0.85 ATF4 (0.57) 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-3704089-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2023-07-19 — — EP disclosed
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