SCHEMBL11049665

SCHEMBL11049665

OC=CCc1c[nH]c(-c2ccccc2)n1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.33
ADK P55263 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CXCR2 P25025 2/20 0.33
DCUN1D1 Q96GG9 2/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
ALPL P05186 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
PIN1 Q13526 2/20 0.32
MAPK1 P28482 1/20 0.32
CASP1 P29466 1/20 0.32

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
SCHEMBL7567734 0.84 KMT2A (0.35) MTORADKNISCHPOLBKMT2A
SCHEMBL729737 0.80 HPGD (0.42) MTORADKNISCHPOLBKMT2A
SCHEMBL672597 0.79 NOTUM (0.42) MTORADKNISCHPOLBKMT2A
SCHEMBL2092717 0.78 MTOR (0.38) MTORADKNISCHPOLBKMT2A
SCHEMBL2780530 0.75 POLB (0.41) MTORADKNISCHPOLBKMT2A
SCHEMBL27641126 0.75 ALPL (0.41) MTORADKNISCHPOLBKMT2A
SCHEMBL30670275 0.74 MTOR (0.38) MTORADKNISCHPOLBKMT2A
SCHEMBL6596072 0.74 KMT2A (0.40) MTORADKNISCHPOLBKMT2A
Phthalic Acid SCHEMBL28142030 0.74 DHODH (0.40) POLBKMT2ACYP1A2CYP2C19KDM4E
Hydroxyamine SCHEMBL7338060 0.73 KMT2A (0.37) MTORADKNISCHPOLBKMT2A

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
JP-59002887-A None JP disclosed
JP-S592887-A DIAZO-BASED HEAT-SENSITIVE RECORDING MATERIAL RICOH CO LTD 1984-01-09 JP disclosed