SCHEMBL7465818

SCHEMBL7465818

Nc1c(Cl)cc(N(CCO)CCO)cc1-c1cc[nH]c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
MCL1 Q07820 1/20 0.32
BACE1 P56817 1/20 0.30
STK4 Q13043 1/20 0.30
STK3 Q13188 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
SCHEMBL7455482 0.84 MAPT (0.34) KMT2AMAPTMEN1LMNASMN1; SMN2
SCHEMBL7466832 0.80 KMT2A (0.33) KMT2AMAPTMEN1LMNATP53
SCHEMBL7456698 0.77 KMT2A (0.35) KMT2AMAPTMEN1LMNATP53
SCHEMBL7460602 0.76 STK4 (0.30) MAPTGAASTK4STK3
SCHEMBL7807385 0.76 KMT2A (0.39) KMT2AMAPTMEN1LMNATP53
SCHEMBL7461140 0.76 STK4 (0.30) STK4STK3
SCHEMBL7465675 0.76 MAPT (0.36) KMT2AMAPTMEN1LMNATP53
SCHEMBL7459254 0.76 CSNK2A1 (0.41) KMT2AMAPTMEN1LMNATP53
SCHEMBL7462653 0.76 STK4 (0.30) MAPTGAASTK4STK3
SCHEMBL7461208 0.74 CYP3A4 (0.45) KMT2AMAPTMEN1LMNATP53

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