SCHEMBL7977423

SCHEMBL7977423

Cc1nc(Cl)nc(-c2ccc(N)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
ALDH1A1 P00352 6/20 0.43
HPGD P15428 4/20 0.43
MAPT P10636 3/20 0.43
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
ACHE P22303 2/20 0.42
KDM4E B2RXH2 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
TP53 P04637 2/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP19A1 P11511 1/20 0.39
LMNA P02545 4/20 0.38
GLA P06280 2/20 0.38
ATM Q13315 1/20 0.38
PKM P14618 1/20 0.37
HTT P42858 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL11779192 0.88 L3MBTL1 (0.62) L3MBTL1MEN1KMT2AALDH1A1HPGD
SCHEMBL3421847 0.86 MEN1 (0.50) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL29605396 0.86 L3MBTL1 (0.60) L3MBTL1MEN1KMT2AALDH1A1HPGD
SCHEMBL25068054 0.81 L3MBTL1 (0.67) L3MBTL1MEN1KMT2AALDH1A1HPGD
SCHEMBL6588776 0.80 L3MBTL1 (0.72) L3MBTL1MEN1KMT2AALDH1A1HPGD
SCHEMBL1760381 0.77 ALDH1A1 (0.52) L3MBTL1MEN1KMT2AALDH1A1HPGD
SCHEMBL8425035 0.76 MEN1 (0.62) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL11780284 0.74 ACHE (0.65) L3MBTL1MEN1KMT2AALDH1A1HPGD
SCHEMBL31633459 0.73 ALDH1A1 (0.69) MEN1KMT2AALDH1A1HPGDMAPT
Methane SCHEMBL28329643 0.73 MEN1 (0.60) MEN1KMT2AALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009143317-A1 TRIAZINE COMPOUNDS AS P13 KINASE AND MTOR INHIBITORS WYETH (US) 2009-11-26 WO disclosed
WO-2009143313-A1 TRIAZINE COMPOUNDS AS P13 KINASE AND MTOR INHIBITORS WYETH (US) 2009-11-26 WO disclosed