SCHEMBL8060773

SCHEMBL8060773

CN(CCO)c1ccc(N)cc1-c1ccn(C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
USP2 O75604 2/20 0.32
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
HBB P68871 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
PRKCI P41743 1/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CG P48736 1/20 0.31
ACHE P22303 1/20 0.31
GAA P10253 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
SCHEMBL7461889 0.89 PIK3CD (0.33) ALDH1A1PIK3CDPIK3CG
SCHEMBL7459948 0.84 CRHR1 (0.35)
SCHEMBL7462012 0.83 GAA (0.32) ALDH1A1KDM4EMAPTKMT2ATP53
SCHEMBL7459394 0.82
SCHEMBL7466684 0.78 ALDH1A1 (0.33) ALDH1A1KDM4EMAPTMEN1USP2
SCHEMBL7466582 0.77
SCHEMBL7456851 0.76 CRHR1 (0.34) ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL7807391 0.76 ALDH1A1 (0.34) ALDH1A1KDM4EMAPTMEN1USP2
SCHEMBL7459377 0.76 CSNK2A1 (0.33) ALDH1A1KDM4EMAPTMEN1USP2
SCHEMBL7460881 0.76 IMPDH2 (0.41) ALDH1A1KDM4EMAPTMEN1USP2

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-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