SCHEMBL11426622

SCHEMBL11426622

COC(=O)c1cc(N)cc(C(=O)Nc2ccc(S(=O)(=O)O)c3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c23)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TIMP3 P35625 5/20 0.60
RECQL P46063 4/20 0.58
KMT2A Q03164 4/20 0.58
HSD17B10 Q99714 4/20 0.58
TDP1 Q9NUW8 4/20 0.58
ALDH1A1 P00352 3/20 0.58
MEN1 O00255 2/20 0.58
USP2 O75604 2/20 0.58
HPSE Q9Y251 4/20 0.53
MAPT P10636 4/20 0.53
P2RY11 Q96G91 4/20 0.53
SIRT2 Q8IXJ6 3/20 0.53
SIRT1 Q96EB6 3/20 0.53
PKM P14618 3/20 0.53
P2RX1 P51575 3/20 0.53
P2RX3 P56373 3/20 0.53
ENPP3 O14638 1/20 0.53
ENTPD3 O75355 1/20 0.53
NR1I2 O75469 1/20 0.53
PRKD3 O94806 1/20 0.53

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
SCHEMBL11430062 0.99 TIMP3 (0.59) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11593603 0.92 TIMP3 (0.68) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11425899 0.86 TIMP3 (0.56) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11406508 0.86 P2RY11 (0.72) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11407259 0.85 TIMP3 (0.55) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11425989 0.84 TIMP3 (0.64) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11432619 0.84 APEX1 (0.46) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11425858 0.83 TIMP3 (0.62) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL3300014 0.83 HSD17B10 (0.74) TIMP3RECQLKMT2AHSD17B10TDP1
SCHEMBL11466093 0.82 TIMP3 (0.67) TIMP3RECQLKMT2AHSD17B10TDP1

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-0008154-A1 Ureylene phenylene anionic naphthalene-sulfonic acids, their use as complement system inhibitors in a body fluid and process for their preparation AMERICAN CYANAMID COMPANY (US) 1980-02-20 EP disclosed
US-4185033-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1980-01-22 US disclosed
US-4185032-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1980-01-22 US disclosed