SCHEMBL23093249

SCHEMBL23093249

O=C(O)COCc1ccc(COCCOC2CCCCO2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HRH3 Q9Y5N1 1/20 0.41
ICAM1 P05362 1/20 0.39
SELE P16581 1/20 0.39
KDM4C Q9H3R0 1/20 0.38
CREBBP Q92793 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
EP300 Q09472 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
HPGD P15428 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
MGLL Q99685 1/20 0.34

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
SCHEMBL23092850 0.87 MEN1 (0.44) MEN1KMT2AHRH3ICAM1SELE
SCHEMBL1933912 0.85 MEN1 (0.49) MEN1KMT2AKDM4CCREBBPL3MBTL1
SCHEMBL23092798 0.84 MEN1 (0.44) MEN1KMT2AICAM1SELEKDM4C
SCHEMBL21657581 0.84 MEN1 (0.48) MEN1KMT2AKDM4CCREBBPL3MBTL1
SCHEMBL18105946 0.83 MEN1 (0.50) MEN1KMT2AHRH3ICAM1SELE
SCHEMBL18105948 0.83 MEN1 (0.50) MEN1KMT2AHRH3ICAM1SELE
SCHEMBL18105947 0.83 MEN1 (0.50) MEN1KMT2AHRH3ICAM1SELE
SCHEMBL18105944 0.83 MEN1 (0.50) MEN1KMT2AHRH3ICAM1SELE
SCHEMBL18105945 0.83 MEN1 (0.50) MEN1KMT2AHRH3ICAM1SELE
SCHEMBL27031980 0.83 KDM4C (0.47) MEN1KMT2AKDM4CL3MBTL1NPC1

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-2021051034-A1 RAS PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2021-03-18 WO disclosed