SCHEMBL7558041

SCHEMBL7558041

Cc1cc(N)cc(-c2ccoc2)c1N(CCO)CCO

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.33
CCNK O75909 1/20 0.31
CDK12 Q9NYV4 1/20 0.31
FYN P06241 1/20 0.31
PDE10A Q9Y233 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7466570 0.85 CSNK2A1 (0.41) CSNK2A1
SCHEMBL7456164 0.78 CSNK2A1 (0.35) CSNK2A1CCNKCDK12ALDH1A1
SCHEMBL7457559 0.77 MAPT (0.34) CSNK2A1CCNKCDK12
SCHEMBL7453301 0.77 ALDH1A1 (0.36) CSNK2A1CCNKCDK12ALDH1A1
SCHEMBL7456688 0.77 ALDH1A1 (0.36) CSNK2A1CCNKCDK12ALDH1A1
SCHEMBL7807702 0.76 ADORA2A (0.39) ALDH1A1
SCHEMBL7459373 0.76 PDE10A (0.30) PDE10A
SCHEMBL7453253 0.76 CYP2A6 (0.43)
SCHEMBL7454386 0.75 PIK3CD (0.37)
SCHEMBL7457314 0.75 CSNK2A1 (0.37) CSNK2A1FYNPDE10AALDH1A1

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