SCHEMBL7800850

SCHEMBL7800850

Nc1ccc(N(CCO)CCO)c(-c2sccc2C=O)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 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
SCHEMBL7800923 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7456608 0.81 MEN1 (0.30)
SCHEMBL7807315 0.81 CYP2A6 (0.40) ALDH1A1
SCHEMBL7461348 0.80 MEN1 (0.31)
SCHEMBL7805966 0.80
SCHEMBL7807463 0.80
SCHEMBL7800903 0.79 ALDH1A1 (0.33) ALDH1A1MAPTHPGD
SCHEMBL6571026 0.78 MEN1 (0.40) ALDH1A1MAPTHPGD
SCHEMBL7807482 0.78
SCHEMBL7812255 0.78 ALDH1A1 (0.31) ALDH1A1MAPTHPGD

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-0943614-B1 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives WELLA AG (DE) 2001-12-12 EP disclosed
US-6042620-A FOR DYEING KERATIN FIBERS SUCH AS HAIR WELLA AG (DE) 2000-03-28 US disclosed
EP-0943614-A2 Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives Wella Aktiengesellschaft (DE) 1999-09-22 EP disclosed