SCHEMBL28254732

SCHEMBL28254732

Cc1ccc(N/N=C/c2cncnc2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 2/20 0.46
▸ KMT2A Q03164 6/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ RAB9A P51151 7/20 0.43
▸ LMNA P02545 7/20 0.43
▸ MAPT P10636 7/20 0.43
▸ NPC1 O15118 6/20 0.43
▸ ALDH1A1 P00352 6/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ GAA P10253 6/20 0.41
▸ PKM P14618 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ RAD52 P43351 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39

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
SCHEMBL28255840 0.87 GFER (0.45) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28253899 0.85 MEN1 (0.42) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28255841 0.84 GFER (0.65) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28255839 0.81 NQO2 (0.43) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28254766 0.80 MEN1 (0.40) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28254690 0.79 GFER (0.47) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28254764 0.79 PKM (0.39) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28253900 0.75 MEN1 (0.45) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28254744 0.74 GAA (0.49) GFERKMT2AMEN1RAB9ALMNA
SCHEMBL28254787 0.74 KMT2A (0.49) GFERKMT2AMEN1RAB9ALMNA

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-108863948-A The hydrazide derivatives and application thereof that pyrimidine replaces 广东东阳光药业有限公司 2018-11-23 — — CN disclosed
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