SCHEMBL7467340

SCHEMBL7467340

CNc1cc(CCO)cc(-c2ccoc2)c1N

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.37
CSNK2A1 P68400 1/20 0.35
CTSD P07339 1/20 0.31
BACE1 P56817 1/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
TOP2A P11388 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
SCHEMBL7458545 0.85 CSNK2A1 (0.34) PLAUCSNK2A1HDAC2HDAC3HDAC1
SCHEMBL7454371 0.83 CSNK2A1 (0.33) PLAUCSNK2A1
SCHEMBL6573351 0.82 TDP1 (0.40) BACE1
SCHEMBL7812060 0.76 PTPN1 (0.39) CTSDBACE1
SCHEMBL7461077 0.76
SCHEMBL7459383 0.76 CSNK2A1 (0.33) PLAUCSNK2A1HDAC2TOP2A
SCHEMBL7456329 0.76 MEN1 (0.36) BACE1HDAC1
SCHEMBL7462747 0.75 PIK3CD (0.31)
SCHEMBL7806004 0.71 LTA4H (0.38) HDAC2HDAC3HDAC1
SCHEMBL7807481 0.71 CDK2 (0.33)

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