SCHEMBL28872504

SCHEMBL28872504

O=C(OBr)c1cc[nH]c(=O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NOTUM Q6P988 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
NSD2 O96028 1/20 0.34
ABL1 P00519 1/20 0.34
PPARG P37231 1/20 0.34
RIN1 Q13671 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
SMYD3 Q9H7B4 1/20 0.33
KDM4E B2RXH2 3/20 0.33
GAA P10253 1/20 0.33
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
CREBBP Q92793 1/20 0.32
FKBP5 Q13451 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
SCHEMBL205408 0.81 CA1 (0.48) KMT2AMEN1L3MBTL1KDM4EGAA
SCHEMBL2969266 0.77 CA12 (0.53) KMT2AMEN1L3MBTL1KDM4ECA12
SCHEMBL1255885 0.75 MEN1 (0.56) KMT2AMEN1NOTUMAPOBEC3GL3MBTL1
SCHEMBL2291968 0.74 KMT2A (0.41) KMT2AMEN1NOTUMAPOBEC3GNSD2
SCHEMBL6163681 0.74 MEN1 (0.44) KMT2AMEN1NOTUMAPOBEC3GL3MBTL1
SCHEMBL11706244 0.74 SLC2A1 (0.46) KMT2AMEN1NOTUMAPOBEC3GJAK2
SCHEMBL23397120 0.72 TDP1 (0.60) KMT2ANSD2ABL1PPARGRIN1
SCHEMBL1116172 0.70 ATM (0.46) L3MBTL1KDM4EGAACA12CA9
SCHEMBL31701218 0.69 MAPT (0.46) KMT2AMEN1CREBBPALDH1A1HPGD
SCHEMBL2896727 0.69 ALDH1A1 (0.47) KMT2AMEN1APOBEC3GNSD2L3MBTL1

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
CN-109562185-A Novel conjugates of agents and moieties capable of binding to glucose-sensing proteins 赛诺菲 2019-04-02 CN disclosed