SCHEMBL8988

SCHEMBL8988

O=C1Nc2ccccc2Sc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 1.00
ALOX15 P16050 2/20 0.63
ALDH1A1 P00352 2/20 0.63
MAPK10 P53779 1/20 0.63
HSD17B10 Q99714 1/20 0.63
MAPT P10636 7/20 0.61
GAA P10253 4/20 0.61
POLB P06746 3/20 0.61
TDP1 Q9NUW8 3/20 0.61
NOX1 Q9Y5S8 3/20 0.61
MAOA P21397 2/20 0.61
BCHE P06276 2/20 0.61
ACHE P22303 2/20 0.61
MEN1 O00255 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
ALOX12 P18054 1/20 0.61
CNR1 P21554 1/20 0.61
PTGS1 P23219 1/20 0.61

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
SCHEMBL7422398 0.82 L3MBTL1 (0.69) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
Anthraquinone SCHEMBL22206675 0.82 NOX1 (0.71) L3MBTL1ALOX15ALDH1A1MAPTGAA
SCHEMBL17085948 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL19984763 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL8878671 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL1567426 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL10669023 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL7710864 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL2113682 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10
SCHEMBL31098239 0.81 L3MBTL1 (0.68) L3MBTL1ALOX15ALDH1A1MAPK10HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118460-A1 PROCESS FOR THE SYNTHESIS OF QUETIAPINE F.I.S. FABBRICA ITALIANA SINTETICI S.P.A (IT) 2011-05-19 US claimed
US-7902355-B2 Condensation of 10H-dibenzo-[b,f][1,4]-thiazepin-11-one with a piperazine derivative in the presence of a titanium alkoxide catalyst; Titanium catalyst easier to handle, have low toxicity, not chlorinated, much less harmful for the environment UNION QUIMICO-FARMACEUTICA S.A. (ES) 2011-03-08 US claimed
EP-1856073-B1 A PROCESS FOR THE PREPARATION OF AN 11-(4-SUBSTITUTED-I-PIPERAZINYL)DIBENZO[b,f][1,4]THIAZEPINE DERIVATIVE UNION QUIMICO FARMA (ES) 2010-05-12 EP claimed
US-20080171869-A1 Process For The Preparation Of An 11-(4-Substituted-I- Piperazinyl)Dibenzo[B,F][1,4:rsqb; Thiazepine Derivative UNION QUIMICO-FARMACEUTICA S.A. (ES) 2008-07-17 US claimed
EP-1565448-A4 METHOD OF PREPARING 10H-DIBENZO b,f 1,4 THIAZEPIN-11-ONE SK HOLDINGS CO LTD (KR) 2008-04-23 EP claimed
US-20070203336-A1 Process for preparing dibenzothiazepine compounds ASTRAZENECA UK LIMITED (GB) 2007-08-30 US claimed
US-7214793-B2 Method of preparing 10H-dibenzo[b,f][11,4]thiazepin-11-one SK CORPORATION (KR) 2007-05-08 US claimed
US-20070066589-A1 Reacting dithiodisalicylic acid with 1-chloro-2-nitrobenzene in a basic aqueous solution; reducing the nitro group of the 2-(2-nitrophenylthio)benzoic acid formed with hydrogen gas, a solvent and a heterogeneous metal catalyst; and cyclizing the product in an organic solvent SK BIOTEK CO., LTD. (KR) 2007-03-22 US claimed
EP-1021190-B1 Amid derivatives as growth hormone release promotors KAKEN PHARMA CO LTD (JP) 2006-11-08 EP claimed
EP-1565448-A2 METHOD OF PREPARING 10H-DIBENZO b,f 1,4 THIAZEPIN-11-ONE SK Corporation (KR) 2005-08-24 EP claimed
WO-2004047722-A2 METHOD OF PREPARING 10H-DIBENZO[b,f][1,4]THIAZEPIN-11-ONE SK CORPORATION (KR) 2004-06-10 WO claimed
CN-117402127-A Preparation method of quetiapine intermediate 苏州敬业医药化工有限公司 2024-01-16 CN disclosed
US-20210017294-A9 ANTIBODIES TO QUETIAPINE HAPTENS AND USE THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-01-21 US disclosed
US-20210017294-A9 ANTIBODIES TO QUETIAPINE HAPTENS AND USE THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-01-21 US disclosed
CN-106413402-B Hepatitis b core protein allosteric modulators 美国印第安纳大学研究和技术公司 2020-10-30 CN disclosed
US-4879288-A Novel dibenzothiazepine antipsychotic ICI AMERICAS INC. (US) 1989-11-07 US disclosed
EP-0282236-A1 Process for the preparation of a thiazepine compound IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-09-14 EP disclosed
US-4728735-A LIPOXYGENASE INHIBITORS MERCK & CO., INC. (US) 1988-03-01 US disclosed
EP-0240228-A1 Thiazepine compounds ICI AMERICAS INC. (US) 1987-10-07 EP disclosed
US-4263207-A ANTIALLERGENS MERCK & CO., INC. (US) 1981-04-21 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 (5 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-20080171869-A1 Process For The Preparation Of An 11-(4-Substituted-I- Piperazinyl)Dibenzo[B,F][1,4:rsqb; Thiazepine Derivative SDHB, SDHA, CYP2F1 L3MBTL1 3398/4885ALOX15 1431/4885ALDH1A1 513/4885
US-20070066589-A1 Reacting dithiodisalicylic acid with 1-chloro-2-nitrobenzene in a basic aqueous solution; reducing the nitro group of the 2-(2-nitrophenylthio)benzoic acid formed with hydrogen gas, a solvent and a heterogeneous metal catalyst; and cyclizing the product in an organic solvent PTGS1, PTGS2, CA2 L3MBTL1 4573/4885ALOX15 63/4885ALDH1A1 754/4885
US-20210017294-A9 ANTIBODIES TO QUETIAPINE HAPTENS AND USE THEREOF HTR4, HTR3C, SLC6A4 L3MBTL1 2785/4885ALOX15 1292/4885ALDH1A1 2245/4885
US-20110118460-A1 PROCESS FOR THE SYNTHESIS OF QUETIAPINE CYP4F11, MAOB, CYP2F1 L3MBTL1 3838/4885ALOX15 873/4885ALDH1A1 1185/4885
US-20070203336-A1 Process for preparing dibenzothiazepine compounds TST, ADH1C, ADH5 L3MBTL1 4710/4885ALOX15 118/4885ALDH1A1 432/4885

“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.