SCHEMBL12636699

SCHEMBL12636699

Cn1nc(C(C)(C)C)c(/N=N/c2c(C#N)c(C(C)(C)C)nn2C)c1N

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.32
CDK1 P06493 1/20 0.32
CDK4 P11802 1/20 0.32
CCNB1 P14635 1/20 0.32
CCND1 P24385 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
CDK9 P50750 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL12636842 1.00 CCNT1 (0.32) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL12636810 0.91 MAPT (0.34) CCNT1CDK1CDK4CCNB1CCND1
SCHEMBL12636838 0.87
SCHEMBL12636844 0.84 GRK6 (0.31)
SCHEMBL12636700 0.84 GAA (0.44) KMT2AMEN1MAPTLMNA
SCHEMBL12636853 0.83 KDM4E (0.32) POLBMAPT
SCHEMBL12636859 0.82 PRKACA (0.31)
SCHEMBL13997029 0.81
SCHEMBL12636816 0.80 TSHR (0.35) KMT2AMEN1POLBMAPT
SCHEMBL12636857 0.80 MEN1 (0.30) KMT2AMEN1POLBMAPT

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
US-7947625-B2 Ink sheet for heat-sensitive transfer recording material, heat-sensitive transfer recording method, ink cartridge and azo dye FUJIFILM CORPORATION (JP) 2011-05-24 US disclosed
US-20070202282-A1 Ink sheet for heat-sensitive transfer recording material, heat-sensitive transfer recording method, ink cartridge and azo dye FUJIFILM CORPORATION (JP) 2007-08-30 US disclosed