SCHEMBL24324289

SCHEMBL24324289

Cc1ccc(C)c(CNC(=O)C23CC(C2)[C@@H](NC(=O)COc2ccc(Cl)c(F)c2)C3)c1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 17/20 0.44
▸ ALDH1A1 P00352 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL19577428 1.00 ATF4 (0.44) ATF4ALDH1A1MEN1KMT2ANPC1
SCHEMBL19577329 0.94 ATF4 (0.44) ATF4NPC1RAB9A
SCHEMBL24324231 0.91 ATF4 (0.44) ATF4ALDH1A1MEN1KMT2ARAB9A
SCHEMBL24322841 0.87 ATF4 (0.44) ATF4ALDH1A1MEN1KMT2ARAB9A
SCHEMBL24322993 0.86 ATF4 (0.46) ATF4MEN1KMT2A
SCHEMBL24323333 0.86 ATF4 (0.46) ATF4MEN1KMT2A
SCHEMBL24323038 0.84 ATF4 (0.48) ATF4
SCHEMBL24323329 0.84 ATF4 (0.46) ATF4ALDH1A1MEN1KMT2A
SCHEMBL24323087 0.84 ATF4 (0.43) ATF4MEN1KMT2ANPC1
SCHEMBL24323279 0.84 ATF4 (0.47) ATF4ALDH1A1KMT2ARAB9A

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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