SCHEMBL1285757

SCHEMBL1285757

CCCCCCCCc1cc[c]s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
KCNH2 Q12809 2/20 0.38
HIF1A Q16665 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
SHBG P04278 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
HSPD1 P10809 1/20 0.38
ADRB3 P13945 1/20 0.38
HTR2C P28335 1/20 0.38
HSPE1 P61604 1/20 0.38
TST Q16762 1/20 0.38

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
SCHEMBL987593 1.00 ESR1 (0.38) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL1286045 1.00 ESR1 (0.38) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL735087 1.00 ESR1 (0.38) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL27868029 1.00 ESR1 (0.38) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL16892538 1.00 ESR1 (0.38) ESR1ADRA2AADORA3TACR2SLC6A2
Magnesium Chloride Anhydrous SCHEMBL28886869 0.93 HTR2A (0.38) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL3380 0.92
SCHEMBL16892561 0.86 SIGMAR1 (0.47) ALDH1A1LMNA
SCHEMBL16892539 0.86 SIGMAR1 (0.47) ALDH1A1LMNA
SCHEMBL16892552 0.86 ESR1 (0.36) ESR1TP53HSD17B10ACHEGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112409375-A Organic small-molecule photovoltaic material based on tetrazine derivative 东华理工大学 2021-02-26 CN claimed
EP-3902023-B1 COMPOSITION CONTAINING ORGANIC SEMICONDUCTOR, SOLUTION FOR FORMING ORGANIC SEMICONDUCTOR LAYER, ORGANIC SEMICONDUCTOR LAYER, AND ORGANIC THIN FILM TRANSISTOR TOSOH CORP (JP) 2024-04-24 EP disclosed
WO-2023120358-A1 PRODUCTION METHOD FOR COMPOUND 住友化学株式会社 2023-06-29 WO disclosed
US-20230142592-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC THIN FILM TRANSISTOR TOSOH CORPORATION (JP) 2023-05-11 US disclosed
EP-4116304-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC THIN FILM TRANSISTOR Tosoh Corporation (JP) 2023-01-11 EP disclosed
CN-115210239-A Aromatic compound, organic semiconductor layer and organic thin film transistor 东曹株式会社 2022-10-18 CN disclosed
US-20220059768-A1 COMPOSITION CONTAINING ORGANIC SEMICONDUCTOR, SOLUTION FOR FORMING ORGANIC SEMICONDUCTOR LAYER, ORGANIC SEMICONDUCTOR LAYER, AND ORGANIC THIN FILM TRANSISTOR TOSOH CORPORATION (JP) 2022-02-24 US disclosed
EP-3902023-A1 COMPOSITION CONTAINING ORGANIC SEMICONDUCTOR, SOLUTION FOR FORMING ORGANIC SEMICONDUCTOR LAYER, ORGANIC SEMICONDUCTOR LAYER, AND ORGANIC THIN FILM TRANSISTOR Tosoh Corporation (JP) 2021-10-27 EP disclosed
CN-113196512-A Composition containing organic semiconductor, solution for forming organic semiconductor layer, and organic thin film transistor 东曹株式会社 2021-07-30 CN disclosed
CN-112409375-A Organic small-molecule photovoltaic material based on tetrazine derivative 东华理工大学 2021-02-26 CN disclosed
US-9490433-B2 Benzothienobenzothiophene derivative, organic semiconductor material, and organic transistor DIC CORPORATION (JP) 2016-11-08 US disclosed
US-20160159973-A1 POLYMER COMPOUND AND ORGANIC SEMICONDUCTOR DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-09 US disclosed
US-9147843-B2 Organic semiconductor material SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-09-29 US disclosed
US-20150228913-A1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR DIC CORPORATION (JP) 2015-08-13 US disclosed
EP-2894685-A1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR DIC Corporation (JP) 2015-07-15 EP disclosed
CN-104769735-A Benzothienobenzothiophene derivative, organic semiconductor material, and organic transistor CENTRE NAT RECH SCIENT 2015-07-08 CN disclosed
US-20150065671-A1 ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-03-05 US disclosed
US-20140151680-A1 POLYMER COMPOUND AND ORGANIC TRANSISTOR USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-06-05 US disclosed
US-8541602-B2 Compound, organic semiconductor material, and semiconductor device DENSO CORPORATION (JP) 2013-09-24 US disclosed
US-20120088921-A1 COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND SEMICONDUCTOR DEVICE DENSO CORPORATION (JP) 2012-04-12 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 (4 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-20230142592-A1 AROMATIC COMPOUND, ORGANIC SEMICONDUCTOR LAYER AND ORGANIC THIN FILM TRANSISTOR CHRM1, CHRM2, ACVRL1 ESR1 170/4885ADRA2A 266/4885ADORA3 1005/4885
US-20120088921-A1 COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND SEMICONDUCTOR DEVICE SCO2, SPIN1, PROX1 ESR1 640/4885ADRA2A 2683/4885ADORA3 2703/4885
US-20160159973-A1 POLYMER COMPOUND AND ORGANIC SEMICONDUCTOR DEVICE USING THE SAME ASH2L, BMI1, SETDB1 ESR1 2634/4885ADRA2A 3416/4885ADORA3 3518/4885
US-20150228913-A1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR TST, TPST2, TPR ESR1 2870/4885ADRA2A 3715/4885ADORA3 2606/4885

“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.