SCHEMBL7461574

SCHEMBL7461574

Cc1cc(N(CCO)CCO)cc(-c2ccn(C)c2)c1N

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.34
PIK3CG P48736 1/20 0.34
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
MCL1 Q07820 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
MMP14 P50281 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
S100B P04271 1/20 0.31

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
SCHEMBL7456698 0.86 KMT2A (0.35) PIK3CDPIK3CGMAPTGAAPKM
SCHEMBL7461504 0.82 S100B (0.36) PIK3CDPIK3CGMAPTGAAPKM
SCHEMBL7454386 0.78 PIK3CD (0.37) PIK3CDPIK3CG
SCHEMBL7455482 0.78 MAPT (0.34) MAPTGAAPKMHTTMCL1
SCHEMBL7456582 0.77 PIK3CD (0.36) PIK3CDPIK3CGS100B
SCHEMBL7459922 0.77 ALDH1A1 (0.36) PIK3CDPIK3CG
SCHEMBL7812154 0.77 MAPT (0.36) MAPTGAAPKMHTTMCL1
SCHEMBL7457559 0.75 MAPT (0.34) MAPTGAAPKMHTTMCL1
SCHEMBL7460463 0.75 CYP2A6 (0.39) MAPTGAAPKMHTTMCL1
SCHEMBL4011860 0.75 MAPT (0.42) MAPTGAAPKMHTTMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0963982-B1 New diaminobenzene derivatives and these componends containing colouring agents WELLA AG (DE) 2002-03-13 EP disclosed
US-6132475-A FOR OXIDATION DYEING OF KERATIN FIBERS; INCLUDES COUPLER AND DEVELOPER, IN WHICH THE DEVELOPER IS A SUBSTITUTED 2-(FURYL, THIENYL, PYRROLYL, OR SELENOPHENE) P-DIAMINOBENZENE DERIVATIVE OF GIVEN FORMULA; COLORFASTNESS, WASHFASTNESS WELLA AKTIENGESELLSCHAFT (DE) 2000-10-17 US disclosed
EP-0963982-A2 New diaminobenzene derivatives and these componends containing colouring agents Wella Aktiengesellschaft (DE) 1999-12-15 EP disclosed