SCHEMBL2623124

SCHEMBL2623124

CNc1cc(Nc2ccccc2)nc(NC(=O)c2ccc(OC)cc2)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.60
ERBB3 P21860 1/20 0.60
KMT2A Q03164 4/20 0.56
MAPT P10636 3/20 0.56
MEN1 O00255 3/20 0.56
KDM4E B2RXH2 2/20 0.56
RECQL P46063 1/20 0.56
KCNK9 Q9NPC2 1/20 0.56
SCD O00767 1/20 0.53
ADORA3 P0DMS8 3/20 0.53
RAB9A P51151 6/20 0.52
NPC1 O15118 5/20 0.52
ADORA2A P29274 1/20 0.52
ADORA1 P30542 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
TP53 P04637 2/20 0.51
PKM P14618 1/20 0.51
LMNA P02545 2/20 0.51
GSK3B P49841 1/20 0.49

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
SCHEMBL2623116 0.89 ADORA1 (0.51) EGFRERBB3KMT2AMAPTMEN1
SCHEMBL2623123 0.89 NPC1 (0.62) EGFRERBB3KMT2AMEN1KCNK9
SCHEMBL2623127 0.88 NPC1 (0.58) EGFRERBB3KMT2AMAPTMEN1
SCHEMBL2623122 0.87 ADORA1 (0.49) KMT2AMAPTMEN1KDM4EADORA3
SCHEMBL16675205 0.87 KMT2A (0.63) EGFRERBB3KMT2AMAPTMEN1
SCHEMBL15308163 0.86 MEN1 (0.66) EGFRERBB3KMT2AMAPTMEN1
SCHEMBL822370 0.84 KMT2A (0.56) EGFRERBB3KMT2AMAPTMEN1
SCHEMBL16675189 0.81 KMT2A (0.73) KMT2AMAPTMEN1KDM4ERECQL
SCHEMBL2623119 0.81 KMT2A (0.58) EGFRERBB3KMT2AMAPTMEN1
SCHEMBL2623115 0.81 KDM4E (0.61) KMT2AMAPTMEN1KDM4ERECQL

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-8158220-B2 Cellulose acylate film, retardation film, polarizer and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed
US-8158220-B2 Cellulose acylate film, retardation film, polarizer and liquid crystal display device FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed