SCHEMBL7460434

SCHEMBL7460434

Cc1cc(N)c(-c2cc[nH]c2)cc1N(CCO)CCO

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.30
MAPT P10636 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
SCHEMBL7465045 0.84 ALDH1A1 (0.36) ALDH1A1GAAMAPT
SCHEMBL7462653 0.84 STK4 (0.30) GAAMAPT
SCHEMBL7459922 0.78 ALDH1A1 (0.36) ALDH1A1
SCHEMBL7459373 0.77 PDE10A (0.30)
SCHEMBL7456707 0.77 GAA (0.32) ALDH1A1GAAMAPT
SCHEMBL7466832 0.77 KMT2A (0.33) ALDH1A1GAAMAPT
SCHEMBL7460602 0.76 STK4 (0.30) GAAMAPT
SCHEMBL7453301 0.76 ALDH1A1 (0.36) ALDH1A1
SCHEMBL7808698 0.76 ALDH1A1 (0.36) ALDH1A1GAAMAPT
SCHEMBL7459640 0.76 CYP2A6 (0.39) ALDH1A1MAPT

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