SCHEMBL25814790

SCHEMBL25814790

C=C(CCNC(=O)COc1ccc(Cl)c(F)c1)NC(=O)c1cc(C(=O)O)ccn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 11/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.38
▸ KDM5A P29375 1/20 0.37
▸ KDM5B Q9UGL1 1/20 0.37

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
SCHEMBL25814872 0.93 KMT2A (0.41) ATF4ALDH1A1KMT2AMEN1RXFP1
SCHEMBL25797260 0.89 ALDH1A1 (0.41) ATF4ALDH1A1KMT2AMEN1RXFP1
SCHEMBL22956222 0.88 MEN1 (0.41) ATF4KMT2AMEN1RXFP1
SCHEMBL25800449 0.88 ALDH1A1 (0.45) ATF4ALDH1A1KMT2AMEN1RXFP1
SCHEMBL22627731 0.88 ATF4 (0.42) ATF4
SCHEMBL22627678 0.87 ALDH1A1 (0.42) ATF4ALDH1A1KMT2AMEN1RXFP1
SCHEMBL22627685 0.87 ALDH1A1 (0.42) ATF4ALDH1A1KMT2AMEN1RXFP1
SCHEMBL22628188 0.87 KMT2A (0.53) ATF4ALDH1A1KMT2AMEN1
SCHEMBL22627861 0.86 HDAC3 (0.42) ATF4ALDH1A1KMT2AMEN1RXFP1
SCHEMBL22627660 0.86 KMT2A (0.52) ATF4ALDH1A1KMT2AMEN1RXFP1

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-3452456-B1 BICYCLIC MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2023-07-05 — — EP disclosed
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