SCHEMBL28619407

SCHEMBL28619407

O=C(Oc1ccccc1)c1cc(C(=O)Oc2ccccc2)cc(-n2cnnn2)c1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.73
MEN1 O00255 2/20 0.58
LMNA P02545 2/20 0.55
TP53 P04637 2/20 0.53
NSD2 O96028 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
NOTUM Q6P988 1/20 0.51
USP2 O75604 1/20 0.49
RAB9A P51151 1/20 0.47
MAPK1 P28482 1/20 0.46

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
SCHEMBL2035745 0.78 NSD2 (0.74) KMT2AMEN1LMNATP53NSD2
SCHEMBL15569573 0.76 NOTUM (0.53) KMT2AMEN1TP53SMN1; SMN2NOTUM
SCHEMBL8535957 0.74 KMT2A (0.64) KMT2AMEN1TP53SMN1; SMN2USP2
SCHEMBL20010538 0.73 KMT2A (0.47) KMT2ATP53SMN1; SMN2NOTUM
SCHEMBL28611383 0.73 CYP3A4 (0.50) KMT2AMEN1NSD2MAPK1
SCHEMBL15825106 0.72 KMT2A (0.71) KMT2AMEN1LMNATP53SMN1; SMN2
SCHEMBL4324303 0.72 SMN1; SMN2 (0.53) KMT2AMEN1TP53SMN1; SMN2NOTUM
SCHEMBL11579444 0.72 NSD2 (0.67) KMT2AMEN1NSD2SMN1; SMN2MAPK1
SCHEMBL6851163 0.71 NSD2 (0.70) KMT2AMEN1LMNATP53NSD2
SCHEMBL31175292 0.71 SMN1; SMN2 (0.71) KMT2AMEN1LMNATP53SMN1; SMN2

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-113292728-A Preparation method and application of polybenzimidazole polymer with high proton conductivity for fuel cell 中国科学院上海有机化学研究所 2021-08-24 CN disclosed