SCHEMBL22395076

SCHEMBL22395076

Cc1cccc(CNC(=O)C23CCC(NC(=O)COc4ccc(Cl)c(F)c4)(CC2)C[C@@H]3O)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 15/20 0.48
▸ P2RX7 Q99572 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ NPY1R P25929 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 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
SCHEMBL19577518 1.00 ATF4 (0.48) ATF4P2RX7MEN1NPY1RKMT2A
SCHEMBL30446203 1.00 ATF4 (0.48) ATF4P2RX7MEN1NPY1RKMT2A
SCHEMBL22395175 0.92 ATF4 (0.48) ATF4P2RX7HTT
SCHEMBL22395092 0.92 ATF4 (0.48) ATF4P2RX7HTT
SCHEMBL19577310 0.92 ATF4 (0.48) ATF4P2RX7HTT
SCHEMBL19577120 0.92 ATF4 (0.48) ATF4P2RX7HTT
SCHEMBL22395289 0.92 ATF4 (0.51) ATF4MEN1KMT2AHTT
SCHEMBL19577520 0.92 ATF4 (0.51) ATF4MEN1KMT2AHTT
SCHEMBL19577117 0.91 ATF4 (0.47) ATF4P2RX7MEN1KMT2AHTT
SCHEMBL19555708 0.91 ATF4 (0.47) ATF4P2RX7MEN1KMT2AHTT

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-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2020-09-09 — — EP disclosed
Send feedback