SCHEMBL14178558

SCHEMBL14178558

CCOc1cc(OC)c([N+]#N)c(OCC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37
TUBA1A Q71U36 1/20 0.37
TUBA1C Q9BQE3 1/20 0.37
TUBB6 Q9BUF5 1/20 0.37
TUBB2B Q9BVA1 1/20 0.37
TUBB1 Q9H4B7 1/20 0.37
CALM1 P0DP23 1/20 0.37
TSHR P16473 2/20 0.36

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
SCHEMBL92011 0.93 NQO1 (0.41) KDM4EGAAMAPTTSHRNQO1
SCHEMBL14430048 0.79 KDM4E (0.32) KDM4EMAPTTSHRNQO1KMT2A
SCHEMBL14178040 0.78 ALDH1A1 (0.46) KDM4EMAPTTSHRKMT2AMAPK1
SCHEMBL4074936 0.77 MAPT (0.37) KDM4EGAAMAPTTSHRLMNA
SCHEMBL17690433 0.76 CA12 (0.37) KDM4EGAAMAPTCALM1TSHR
SCHEMBL13829464 0.75 CALM1 (0.35) KDM4EGAAMAPTCALM1TSHR
SCHEMBL14588710 0.74 MAOB (0.50) GAAMAPTLMNAKMT2AMAPK1
SCHEMBL12863738 0.74 KMT2A (0.38) KDM4EGAAMAPTTUBB4ATUBB
SCHEMBL92094 0.73 PLA2G2A (0.41) TSHRAHR
SCHEMBL14588704 0.73 TDP1 (0.38) MAPTTSHRLMNAKMT2AMAPK1

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
US-20080113296-A1 Photosensitive recording layer of sensityzing dye, polymerization initiator, polymerizable compound, binder polymer, protective oxygen barrier layer; backcoat layer of epoxy resin; infrared absorber; scratches prevented without interleaving slip sheets FUJIFILM CORPORATION (JP) 2008-05-15 US disclosed