SCHEMBL7467274

SCHEMBL7467274

CC(=O)c1cscc1-c1cc(N)ccc1N(CCO)CCO

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
PABPC1 P11940 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL7460684 0.84 CYP2A6 (0.37) ALDH1A1MEN1PABPC1KMT2A
SCHEMBL7463361 0.83 ALDH1A1 (0.32) ALDH1A1MEN1PABPC1KMT2A
SCHEMBL7456750 0.82 MEN1 (0.31) MEN1PABPC1KMT2A
SCHEMBL7457440 0.81 ALDH1A1 (0.33) ALDH1A1MEN1PABPC1KMT2A
SCHEMBL7461348 0.81 MEN1 (0.31) MEN1PABPC1KMT2A
SCHEMBL7800903 0.80 ALDH1A1 (0.33) ALDH1A1MEN1PABPC1KMT2A
SCHEMBL7456111 0.80 ALDH1A1 (0.33) ALDH1A1MEN1PABPC1KMT2A
SCHEMBL7460430 0.79
SCHEMBL7467900 0.79 MAPT (0.31) ALDH1A1MEN1KMT2A
SCHEMBL1380335 0.78 KDM4E (0.43) ALDH1A1MEN1KMT2A

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