SCHEMBL21746148

SCHEMBL21746148

CN/N=C(Cl)\C=C(/C)C1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.33
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL21745533 0.77 SIGMAR1 (0.32) CTSK
SCHEMBL24798331 0.70
SCHEMBL22568096 0.63 CES2 (0.35) CTSKMEN1LMNAKMT2A
SCHEMBL9609535 0.63 CES2 (0.46) MEN1LMNAKMT2A
SCHEMBL13468227 0.63 CES2 (0.40) MEN1LMNAKMT2A
SCHEMBL10891915 0.63 CES2 (0.35) CTSK
SCHEMBL13468229 0.63 SMN1; SMN2 (0.41)
SCHEMBL17468855 0.63 CES2 (0.36) MEN1LMNAKMT2A
SCHEMBL11789278 0.62
SCHEMBL13468247 0.62 SMN1; SMN2 (0.43) MEN1LMNAKMT2A

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-2944637-B1 NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2020-02-19 EP disclosed