SCHEMBL17692574

SCHEMBL17692574

CC(C)COCC(C)N1C(=O)c2ccc(Oc3ccc4c(c3)C(=O)N(C)C4=O)cc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ HTT P42858 1/20 0.43
▸ MAPK1 P28482 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.41
▸ POLB P06746 3/20 0.40
▸ LPAR1 Q92633 1/20 0.40
▸ LPAR3 Q9UBY5 1/20 0.40
▸ APP P05067 1/20 0.39
▸ APAF1 O14727 1/20 0.38
▸ TRIM24 O15164 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ F2 P00734 1/20 0.35

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
SCHEMBL17692572 0.87 KDM4E (0.40) ALDH1A1KMT2AKDM4EMEN1MAPK1
SCHEMBL17692569 0.84 PRMT1 (0.40) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL12565092 0.81 ALDH1A1 (0.48) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL17692575 0.79 TERT (0.40) ALDH1A1KMT2AKDM4EMEN1MAPK1
SCHEMBL262253 0.78 ALDH1A1 (0.57) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL18914733 0.77 ALDH1A1 (0.48) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL14106913 0.77 ALDH1A1 (0.56) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL26488393 0.75 ALDH1A1 (0.46) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL12540869 0.74 POLB (0.53) ALDH1A1KMT2AKDM4EMEN1HTT
SCHEMBL8737302 0.73 LPAR1 (0.61) ALDH1A1KMT2AKDM4EMEN1HTT

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-20160111626-A1 FLEXIBLE CONDUCTIVE MATERIAL AND TRANSDUCER SUMITOMO RIKO COMPANY LIMITED (JP) 2016-04-21 — — US disclosed
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