SCHEMBL23729795

SCHEMBL23729795

CCC(=O)COCCOCCNC(=O)CN(C)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GLP1R P43220 8/20 0.31
APP P05067 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA4 P22748 2/20 0.30
CA9 Q16790 2/20 0.30
CA14 Q9ULX7 2/20 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
SCHEMBL23729570 0.84 MEN1 (0.41) MEN1KMT2AAPPCA12CA1
SCHEMBL26700492 0.84 MEN1 (0.41) MEN1KMT2AAPPCA12CA1
SCHEMBL26707240 0.83 MEN1 (0.42) MEN1KMT2ACA12CA1CA2
SCHEMBL23729600 0.81 MEN1 (0.44) MEN1KMT2ACA12CA1CA2
SCHEMBL21106543 0.80 MEN1 (0.47) MEN1KMT2AGLP1RCA12CA1
SCHEMBL25831170 0.80 KMT2A (0.45) MEN1KMT2AGLP1R
SCHEMBL25029532 0.77 MEN1 (0.44) MEN1KMT2AGLP1R
SCHEMBL21026058 0.77 ALDH1A1 (0.35) MEN1KMT2A
SCHEMBL21106879 0.76 KMT2A (0.56) MEN1KMT2AGLP1RCA2
SCHEMBL22374969 0.76 SMN1; SMN2 (0.41) MEN1KMT2A

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
WO-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed