SCHEMBL15965460

SCHEMBL15965460

COCCOCCOCCOc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 1/20 0.46
PTK2B Q14289 1/20 0.46
KDM4E B2RXH2 10/20 0.43
HPGD P15428 1/20 0.41
USP2 O75604 1/20 0.40
S1PR3 Q99500 1/20 0.39
PTPN11 Q06124 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL15965504 0.91 KMT2A (0.47) ALDH1A1KMT2APTK2BKDM4ES1PR3
SCHEMBL15965483 0.88 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDL3MBTL1MAPT
SCHEMBL15965507 0.87 ALDH1A1 (0.49) ALDH1A1KMT2APTK2BKDM4EPTPN11
SCHEMBL26235402 0.86 ALDH1A1 (0.54) ALDH1A1KMT2APTK2BKDM4EUSP2
SCHEMBL15965494 0.82 ALDH1A1 (0.43) ALDH1A1KMT2APTK2BKDM4EMAPT
SCHEMBL15965484 0.82 HTT (0.39) ALDH1A1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL15965451 0.82 ALDH1A1 (0.41) ALDH1A1KMT2AKDM4EHPGDMAPT
SCHEMBL15965452 0.82 ALDH1A1 (0.46) ALDH1A1KMT2APTK2BKDM4EHPGD
SCHEMBL1505121 0.81 KDM4E (0.52) ALDH1A1KMT2APTK2BKDM4EHPGD
SCHEMBL15965488 0.80 ALDH1A1 (0.40) ALDH1A1KMT2APTK2BKDM4EHPGD

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-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed