SCHEMBL2295683

SCHEMBL2295683

COc1cc(NC(=O)c2cccc(S(=O)(=O)O)c2)c(C)cc1N

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
GAA P10253 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
BRPF1 P55201 1/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
LMNA P02545 2/20 0.43
HPGD P15428 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL2298436 0.91 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL131762 0.83 MEN1 (0.62) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL29407250 0.83 MEN1 (0.62) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL11786286 0.81 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AKDM4EMAPT
Sulfanilamide SCHEMBL9771935 0.79 MAPT (0.53) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL2294111 0.79 LMNA (0.51) ALDH1A1KMT2AGAAKDM4EMAPT
SCHEMBL11691574 0.78 ALDH1A1 (0.61) ALDH1A1MEN1KMT2AGAAKDM4E
SCHEMBL11785381 0.77 SMN1; SMN2 (0.52) ALDH1A1MEN1KMT2AGAAKDM4E
SCHEMBL11785068 0.76 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL11695109 0.76 KDM4E (0.64) ALDH1A1MEN1KMT2AKDM4EMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2110413-B1 DISPERSING AGENT FOR ORGANIC PIGMENT AND USE THEREOF DAINICHISEIKA COLOR CHEM (JP) 2013-03-20 EP disclosed
US-7993446-B2 Dispersing agent for organic pigment and use thereof DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2011-08-09 US disclosed
US-20100315733-A1 DISPERSING AGENT FOR ORGANIC PIGMENT AND USE THEREOF DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 2010-12-16 US disclosed
EP-2110413-A1 DISPERSING AGENT FOR ORGANIC PIGMENT AND USE THEREOF Dainichiseika Color & Chemicals Mfg. Co., Ltd. (JP) 2009-10-21 EP disclosed