SCHEMBL20353050

SCHEMBL20353050

Cn1c(C(C)(C)C)c(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ PADI4 Q9UM07 3/20 0.39
▸ MAPK14 Q16539 1/20 0.38
▸ KDM4E B2RXH2 5/20 0.37
▸ GAA P10253 1/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ GPR3 P46089 1/20 0.37
▸ RCE1 Q9Y256 1/20 0.37
▸ HSD17B10 Q99714 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ CYP2C19 P33261 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ MEN1 O00255 1/20 0.34

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
SCHEMBL20353054 1.00 KMT2A (0.43) KMT2ALMNASMN1; SMN2PADI4MAPK14
SCHEMBL20352888 0.91 KMT2A (0.37) KMT2ALMNASMN1; SMN2PADI4MAPK14
SCHEMBL20352887 0.89 PPARG (0.38) KMT2ALMNASMN1; SMN2PADI4MAPK14
SCHEMBL17883061 0.81 ALDH1A1 (0.48) KMT2ALMNASMN1; SMN2GPR3HSD17B10
SCHEMBL20352857 0.80 ACHE (0.42) KMT2ALMNASMN1; SMN2MAPK14KDM4E
SCHEMBL27964800 0.76 KMT2A (0.58) KMT2ALMNASMN1; SMN2PADI4MAPK14
SCHEMBL18564772 0.72 GPR3 (0.48) KMT2ALMNASMN1; SMN2KDM4EGPR3
SCHEMBL18564825 0.72 RXRA (0.57) KMT2ALMNAKDM4EGAAGPR3
SCHEMBL18564782 0.72 TSPO (0.50) KMT2AKDM4EGPR3HSD17B10HPGD
SCHEMBL18564813 0.72 RXRA (0.50) KMT2ALMNAKDM4EGAAGPR3

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
WO-2018119729-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUND DOW GLOBAL TECHNOLOGIES LLC (US) 2018-07-05 — — WO disclosed
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