SCHEMBL28804322

SCHEMBL28804322

c1ccc(-c2ccccc2-c2csnn2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.66
RAB9A P51151 4/20 0.66
MEN1 O00255 2/20 0.66
NPC1 O15118 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
LMNA P02545 1/20 0.61
ALDH1A1 P00352 5/20 0.49
HPGD P15428 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
POLB P06746 2/20 0.46
NOTUM Q6P988 1/20 0.46
MAPT P10636 2/20 0.43
PKM P14618 1/20 0.43
AKT1 P31749 2/20 0.39
MAPK1 P28482 2/20 0.38
GAA P10253 1/20 0.38
MGLL Q99685 1/20 0.38

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
SCHEMBL27991933 0.85 KMT2A (0.61) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL69349 0.83 KMT2A (0.91) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL2682787 0.79 KMT2A (1.00) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL5328204 0.78 LMNA (0.54) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL3038831 0.78 KMT2A (0.81) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL28160870 0.77 KMT2A (0.56) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL9168473 0.76 LMNA (0.61) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL9978626 0.76 LMNA (0.61) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL1655677 0.76 LMNA (0.61) KMT2ARAB9AMEN1NPC1SMN1; SMN2
SCHEMBL29683522 0.76 LMNA (0.61) KMT2ARAB9AMEN1NPC1SMN1; 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-103159653-A Method for producing methionine SUMITOMO CHEMICAL CO 2013-06-19 CN disclosed