SCHEMBL23890802

SCHEMBL23890802

CCOOCCN(C)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
GAA P10253 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL872556 0.79 CHRNB2 (0.37) CHRNB2CHRNA4MEN1KMT2ACHRM2
SCHEMBL14707175 0.78 MEN1 (0.42) CHRNB2CHRNA4MEN1KMT2ACHRM2
SCHEMBL3478490 0.76
SCHEMBL18699689 0.75 MEN1 (0.34) CHRNB2CHRNA4MEN1KMT2ACHRM2
SCHEMBL15359184 0.75 MGAM (0.41) CHRNB2CHRNA4MEN1KMT2ACHRM2
SCHEMBL8064652 0.72 ALDH1A1 (0.41) LMNA
SCHEMBL29879121 0.72 BLM (0.36) CHRNB2CHRNA4MEN1KMT2ACHRM2
SCHEMBL10244731 0.72
SCHEMBL464490 0.72 CHRNB2 (0.43) CHRNB2CHRNA4MEN1KMT2ACHRM2
SCHEMBL16526222 0.71 KDM5A (0.44) LMNA

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-3889154-A1 HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Wuhan LL Science And Technology Development Co., Ltd. (CN) 2021-10-06 EP disclosed