SCHEMBL7653343

SCHEMBL7653343

CC(=O)Nc1ccc(S(=O)(=O)O)c2cc(S(=O)(=O)O)cc(O)c12.O=C(Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c12)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 2/20 0.71
TIMP3 P35625 5/20 0.52
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
RECQL P46063 3/20 0.52
HSD17B10 Q99714 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
USP2 O75604 2/20 0.52
ALDH1A1 P00352 2/20 0.52
ENPP2 Q13822 2/20 0.50
HPSE Q9Y251 4/20 0.48
CYP1A2 P05177 2/20 0.48
NSD2 O96028 2/20 0.48
MAPT P10636 2/20 0.48
PKM P14618 2/20 0.48
P2RX1 P51575 2/20 0.48
P2RX3 P56373 2/20 0.48
ENPP3 O14638 1/20 0.48
ENTPD3 O75355 1/20 0.48
NR1I2 O75469 1/20 0.48

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
SCHEMBL30818027 0.89 APEX1 (0.66) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL4649703 0.89 APEX1 (0.66) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL9803468 0.88 KMT2A (0.53) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL7653352 0.87 APEX1 (0.58) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL9723952 0.84 APEX1 (0.66) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL942276 0.84 CASP6 (0.51) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL9411865 0.84 APEX1 (1.00) APEX1KMT2AMEN1HSD17B10TDP1
SCHEMBL1413131 0.84 APEX1 (1.00) APEX1KMT2AMEN1HSD17B10TDP1
SCHEMBL11512263 0.84 TIMP3 (0.68) APEX1TIMP3KMT2AMEN1RECQL
SCHEMBL11511316 0.83 RECQL (0.71) APEX1TIMP3KMT2AMEN1RECQL

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6485527-B1 Use of reactive dyes for dyeing hair BASF AKTIENGESELLSCHAFT (DE) 2002-11-26 US disclosed
US-6197941-B1 TRIAZINE, METALLIZED, AZO, ANTHRAQUINONE, FORMAZAN, PHTHALOCYANINE, AND DIOXAZINE DYES BASF AKTIENGESELLSCHAFT (DE) 2001-03-06 US disclosed
EP-0733680-B1 Reactive dyes with a benzo-anellated heterocycle as reactive group BASF AG (DE) 2000-01-05 EP disclosed
EP-0733680-A2 Reactive dyes with a benzo-anellated heterocycle as reactive group BASF AKTIENGESELLSCHAFT (DE) 1996-09-25 EP disclosed
US-5241055-A Use in cold pad-batch processing; fixing; fiber bonding; color- and washfastness; monoazo-, disazo-formazan, triphenyldioxazine and metal phthalocyanine dyes BASF AKTIENGESELLSCHAFT (DE) 1993-08-31 US disclosed