SCHEMBL246872

SCHEMBL246872

O=Cc1csc(-c2cccs2)c1C=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.45
DPP4 P27487 1/20 0.42
CYP2A6 P11509 2/20 0.38
LMNA P02545 2/20 0.36
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
KDM4E B2RXH2 5/20 0.33
TDP1 Q9NUW8 3/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 3/20 0.33
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL498579 0.89 DPP4 (0.55) ERN1DPP4LMNAMEN1KMT2A
SCHEMBL14656756 0.88 ERN1 (0.39) ERN1DPP4CYP2A6LMNAKDM4E
SCHEMBL10551506 0.82 ERN1 (0.45) ERN1DPP4CYP2A6LMNAMEN1
SCHEMBL30306315 0.76 KDM4E (0.43) ERN1DPP4LMNAMEN1KMT2A
SCHEMBL30306314 0.76 KDM4E (0.43) ERN1DPP4LMNAMEN1KMT2A
SCHEMBL9231804 0.76 ERN1 (0.49) ERN1DPP4CYP2A6LMNAMEN1
SCHEMBL28623649 0.75 MEN1 (0.34) ERN1DPP4CYP2A6MEN1KMT2A
SCHEMBL4496788 0.71 DPP4 (0.50) ERN1DPP4LMNAMEN1KMT2A
SCHEMBL31231819 0.69 ERN1 (0.54) ERN1DPP4LMNAMEN1KMT2A
SCHEMBL14656755 0.69 DPP4 (0.44) ERN1DPP4LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118978539-A Chiral bithiophene-dinitrogen oxygen ligand, preparation method thereof and application thereof in asymmetric catalytic reaction 贵州大学 2024-11-19 CN claimed
CN-113321791-B Cadmium and nickel complex of two polymerized bithiophene derivatives and preparation method and application thereof 湘潭大学 2022-04-08 CN claimed
CN-113321791-A Cadmium and nickel complex of two polymerized bithiophene derivatives and preparation method and application thereof 湘潭大学 2021-08-31 CN claimed
CN-118978539-A Chiral bithiophene-dinitrogen oxygen ligand, preparation method thereof and application thereof in asymmetric catalytic reaction 贵州大学 2024-11-19 CN disclosed
CN-113321791-B Cadmium and nickel complex of two polymerized bithiophene derivatives and preparation method and application thereof 湘潭大学 2022-04-08 CN disclosed
CN-113321791-A Cadmium and nickel complex of two polymerized bithiophene derivatives and preparation method and application thereof 湘潭大学 2021-08-31 CN disclosed
EP-2405505-B1 ORGANIC THIN FILM TRANSISTOR KYUSHU INST TECH (JP) 2020-03-04 EP disclosed
EP-3036305-B1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2019-04-17 EP disclosed
US-9917260-B2 Compounds with terminal heteroarylcyanovinylene groups and their use in organic solar cells BASF SE (DE) 2018-03-13 US disclosed
US-20160248021-A1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2016-08-25 US disclosed
EP-3036305-A1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2016-06-29 EP disclosed
WO-2015024848-A1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2015-02-26 WO disclosed
US-8674347-B2 Organic semiconductor material and organic thin-film transistor KYUSHU INSTITUTE OF TECHNOLOGY (JP) 2014-03-18 US disclosed
EP-2559720-A1 CROSSLINKED COMPOSITION Daicel Corporation (JP) 2013-02-20 EP disclosed
US-20130026458-A1 CROSSLINKABLE COMPOSITION DAICEL CORPORATION (JP) 2013-01-31 US disclosed
EP-2405505-A1 ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC THIN FILM TRANSISTOR Kyushu Institute of Technology (JP) 2012-01-11 EP disclosed
US-20120001162-A1 ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC THIN-FILM TRANSISTOR KYUSHU INSTITUTE OF TECHNOLOGY (JP) 2012-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130026458-A1 CROSSLINKABLE COMPOSITION DDC, ODC1, SRM ERN1 1867/4885DPP4 4713/4885CYP2A6 4063/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.