SCHEMBL22497632

SCHEMBL22497632

N#Cc1ccccc1Nc1ccccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.50
GAA P10253 7/20 0.50
MAPT P10636 6/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP2D6 P10635 1/20 0.50
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 2/20 0.47
CYP3A4 P08684 1/20 0.47
HSD17B10 Q99714 2/20 0.47
TP53 P04637 1/20 0.47
APP P05067 1/20 0.47
ALOX15 P16050 1/20 0.47
SNCA P37840 1/20 0.47

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
SCHEMBL395135 0.87 KDM4E (0.55) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL30804597 0.87 KDM4E (0.55) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL30804592 0.87 KDM4E (0.55) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL22313826 0.81 KDM4E (0.46) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL31495131 0.81 KDM4E (0.46) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL28191022 0.80 MAPT (0.43) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL2677107 0.80 MAPT (0.71) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL3286845 0.76 KDM4E (0.46) KDM4EGAALMNAHPGDSMN1; SMN2
SCHEMBL29381642 0.76 KDM4E (0.46) KDM4EGAAALDH1A1LMNACYP1A2
SCHEMBL11668949 0.76 TSHR (0.59) KDM4EGAAMAPTMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111747937-B 1,3, 5-triazine compound, composition and application thereof 吉林省元合电子材料有限公司 2022-01-14 CN disclosed
CN-111747937-A 1,3, 5-triazine compound, composition and application thereof 吉林省元合电子材料有限公司 2020-10-09 CN disclosed
WO-2020199998-A1 1,3,5-TRIAZINE COMPOUND AND COMPOSITION, AND APPLICATION THEREOF 吉林省元合电子材料有限公司 2020-10-08 WO disclosed
CN-1272316-C Benzamides and related inhibitors of factor Xa COR THERAPEUTICS INC (US) 2006-08-30 CN disclosed
CN-1391555-A Benzamides and related inhibitors of factor Xa COR THERAPEUTICS INC (US) 2003-01-15 CN disclosed