SCHEMBL24322967

SCHEMBL24322967

O=C(COc1ccc(Cl)c(F)c1)N[C@H]1C[C@@H](C(=O)NCc2ccc(F)cc2)C2CC1C2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 10/20 0.48
▸ LMNA P02545 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ SLC13A5 Q86YT5 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL24324506 1.00 ATF4 (0.48) ATF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL24322873 0.94 ATF4 (0.48) ATF4ALDH1A1
SCHEMBL24324216 0.94 ATF4 (0.49) ATF4
SCHEMBL24322885 0.94 ATF4 (0.49) ATF4
SCHEMBL24323450 0.93 GAA (0.47) ATF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL19577482 0.93 GAA (0.47) ATF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL24322956 0.93 GAA (0.47) ATF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL24323140 0.92 ATF4 (0.46) ATF4LMNAGAAALDH1A1MEN1
SCHEMBL19577445 0.92 ATF4 (0.46) ATF4LMNAGAAALDH1A1MEN1
SCHEMBL24322820 0.92 ATF4 (0.47) ATF4ALDH1A1

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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