SCHEMBL7014167

SCHEMBL7014167

CS(=O)(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.67
CNR1 P21554 8/20 0.52
AKR1B1 P15121 1/20 0.50
BRD4 O60885 1/20 0.48
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP1A2 P05177 1/20 0.46
FLT3 P36888 1/20 0.46
CYP2A6 P11509 1/20 0.46
AOC3 Q16853 2/20 0.45
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
DAO P14920 2/20 0.44
HPGD P15428 1/20 0.44
SRD5A2 P31213 1/20 0.44
DDO Q99489 1/20 0.44

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
Quinoline SCHEMBL28309176 0.84 CA2 (0.50) CA2CNR1AKR1B1MAPTALDH1A1
SCHEMBL28568569 0.83 CA2 (0.71) CA2CNR1AKR1B1BRD4KDM4E
SCHEMBL329510 0.82 CA2 (0.69) CA2CNR1AKR1B1BRD4KDM4E
SCHEMBL19928719 0.81 CA2 (0.58) CA2CNR1AKR1B1BRD4KDM4E
SCHEMBL32681985 0.80 CA2 (1.00) CA2CNR1AKR1B1FLT3CYP2A6
SCHEMBL516901 0.80 CA2 (0.67) CA2CNR1AKR1B1BRD4KDM4E
SCHEMBL29560278 0.80 CA2 (0.67) CA2CNR1AKR1B1BRD4KDM4E
SCHEMBL32895 0.80 CA2 (1.00) CA2CNR1AKR1B1FLT3CYP2A6
SCHEMBL517161 0.80 CA2 (0.67) CA2CNR1AKR1B1BRD4KDM4E
SCHEMBL5610313 0.80 CA2 (0.67) CA2CNR1AKR1B1BRD4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112538034-B Synthetic method of florfenicol 山东国邦药业有限公司 2023-01-31 CN disclosed
CN-112538034-A Synthetic method of florfenicol 山东国邦药业有限公司 2021-03-23 CN disclosed
WO-2005065688-A1 NEW DERIVATIVES OF 6-4{4-[1H-INDOLE-2-SULPHONYL)-PIPERAZIN-1-CARBONYL-PHENYL]}PYRADIZIN-3-ONE ASTRAZENECA AB (SE) 2005-07-21 WO disclosed
EP-1268421-A2 PHENYL-SUBSTITUTED INDOLES AS HISTAMINE H3-RECEPTOR ANTAGONISTS Ortho-McNeil Pharmaceutical, Inc. (US) 2003-01-02 EP disclosed
WO-2001074773-A2 PHENYL-SUBSTITUTED INDOLES AS HISTAMINE H3-RECEPTOR ANTAGONISTS ORTHO MCNEIL PHARMACEUTICAL, INC. (US) 2001-10-11 WO disclosed
US-5436264-A Adrenergic blocking agents for vasoconstriction and hypotensive agents SYNTEX (U.S.A.) INC. (US) 1995-07-25 US disclosed
EP-0279263-B1 INDOLE, BENZOFURAN, BENZOTHIOPHENE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1993-08-04 EP disclosed
US-4873259-A Indole, benzofuran, benzothiophene containing lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-10-10 US disclosed
EP-0279263-A2 Indole, benzofuran, benzothiophene containing lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1988-08-24 EP disclosed