SCHEMBL753260

SCHEMBL753260

Oc1cccc(-c2nccs2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.60
HSD17B1 P14061 10/20 0.56
CYP2A6 P11509 1/20 0.53
HSD17B2 P37059 9/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP19A1 P11511 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.49
KAT6A Q92794 1/20 0.48
SMPD3 Q9NY59 1/20 0.47
FFAR1 O14842 1/20 0.47
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL31609722 1.00 PDPK1 (0.60) PDPK1HSD17B1CYP2A6HSD17B2CYP3A4
SCHEMBL15805858 0.86 PDPK1 (0.72) PDPK1CYP2A6LOXL2KAT6ASMPD3
SCHEMBL31418083 0.86 CYP2A6 (0.55) PDPK1HSD17B1CYP2A6HSD17B2CYP3A4
SCHEMBL16159287 0.82 PDPK1 (0.67) PDPK1CYP2A6LOXL2KAT6ASMPD3
SCHEMBL6067979 0.80 SMPD3 (0.58) PDPK1CYP2A6LOXL2KAT6ASMPD3
SCHEMBL4425765 0.79 PDPK1 (0.74) PDPK1CYP2A6LOXL2KAT6ASMPD3
SCHEMBL468088 0.78 PDPK1 (0.60) PDPK1CYP2A6CYP19A1LOXL2KAT6A
SCHEMBL173979 0.78 PDPK1 (0.60) PDPK1CYP2A6LOXL2KAT6AFFAR1
SCHEMBL20550702 0.78 PDPK1 (0.60) PDPK1CYP2A6CYP19A1LOXL2KAT6A
SCHEMBL7609803 0.78 PDPK1 (0.60) PDPK1CYP2A6CYP19A1LOXL2KAT6A

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107266505-B Tetradentate ring metal platinum (II) complex phosphorescence luminescent material 浙江工业大学 2021-11-23 CN disclosed
CN-107417733-B Quadridentate ring metal palladium (II) complex phosphorescence luminescent material 浙江工业大学 2020-10-27 CN disclosed
CN-108976223-A Fused tricyclic class compound and its application in drug 广东东阳光药业有限公司 2018-12-11 CN disclosed
CN-107417733-A Quadridentate ring metal palladium (II) complex phosphorescence luminescent material 浙江工业大学 2017-12-01 CN disclosed
CN-107266505-A Tetradentate ring metal platinum (II) complex phosphorescence luminescent material 浙江工业大学 2017-10-20 CN disclosed
US-8569285-B2 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2013-10-29 US disclosed
EP-1663979-B1 PHENYL OR PYRIDYL AMIDE COMPOUNDS AS PROSTAGLANDIN E2 ANTAGONISTS RAQUALIA PHARMA INC (JP) 2013-10-09 EP disclosed
CN-1867551-B Phenyl or pyridyl amide compounds as prostaglandin E2 antagonists RAQUALIA PHARMA INC 2013-09-11 CN disclosed
CN-103153973-A Dihydrobenzoxathiazepine derivatives, preparation thereof, pharmaceutical compositions and use as AMPA receptor modulators SERVIER LAB 2013-06-12 CN disclosed
EP-2431360-B1 Derivatives of dihydrobenzoxathiazepine, method of preparing same and pharmaceutical compositions containing them as well as their uses as modulators of AMPA receptors SERVIER LAB (FR) 2013-04-17 EP disclosed
WO-2005021508-A1 PHENYL OR PYRIDYL AMIDE COMPOUNDS AS PROSTAGLANDIN E2 ANTAGONISTS PFIZER INC. (US) 2005-03-10 WO disclosed
WO-1994002844-A1 THIOBENZOYLATION METHOD OF PEPTIDE SEQUENCING WITH GAS CHROMATOGRAPHY AND MASS SPECTROMETRIC DETECTION CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1994-02-03 WO disclosed
US-5246865-A Thiobenzoylation method of peptide sequencing with gas chromatography and mass spectrometric detection CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1993-09-21 US disclosed
EP-0556123-A1 Pyrethrinoid esters of thiazolylalcohols, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1993-08-18 EP disclosed
EP-0264198-B1 OPTICAL INFORMATION RECORDING MEDIUM CANON KABUSHIKI KAISHA (JP) 1993-03-03 EP disclosed
US-5178995-A Reflectance, storage stability CANON KABUSHIKI KAISHA (JP) 1993-01-12 US disclosed
EP-0264198-A2 Optical information recording medium CANON KABUSHIKI KAISHA (JP) 1988-04-20 EP disclosed
EP-0097720-B1 PROCESS FOR PREPARING SILVER HALIDE EMULSION KONICA CORPORATION (JP) 1986-11-26 EP disclosed
EP-0041021-B1 CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION, THEIR USE AGAINST PARASITES IN PLANTS AND ANIMALS, THEIR COMPOSITIONS AND THEIR INTERMEDIATES ROUSSEL-UCLAF (FR) 1984-07-25 EP disclosed
EP-0041021-A2 Cyclopropane carboxylic acid derivatives, their preparation, their use against parasites in plants and animals, their compositions and their intermediates ROUSSEL-UCLAF (FR) 1981-12-02 EP disclosed