SCHEMBL25812841

SCHEMBL25812841

CCCCc1ccc(C(=O)NC2C[C@H](NC(=O)COc3ccc(Cl)c(F)c3)C3CC2C3)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 18/20 0.44
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ BACE1 P56817 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
SCHEMBL25796821 0.86 ATF4 (0.42) ATF4KDM4EMEN1ALDH1A1LMNA
SCHEMBL19568243 0.86 ATF4 (0.46) ATF4KDM4EMEN1ALDH1A1LMNA
SCHEMBL20992457 0.86 ATF4 (0.42) ATF4KDM4EMEN1ALDH1A1LMNA
SCHEMBL25804588 0.86 ATF4 (0.48) ATF4BACE1
SCHEMBL25804612 0.82 ATF4 (0.49) ATF4
SCHEMBL25812672 0.82 ATF4 (0.49) ATF4
SCHEMBL25796952 0.82 ATF4 (0.47) ATF4
SCHEMBL25781247 0.82 ATF4 (0.48) ATF4
SCHEMBL19568275 0.82 ATF4 (0.46) ATF4BACE1
SCHEMBL19555878 0.81 ATF4 (0.55) ATF4KDM4EMEN1ALDH1A1LMNA

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
Send feedback