SCHEMBL827340

SCHEMBL827340

CCOc1ccc2cc[nH]c2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
POLB P06746 1/20 0.65
MAPK1 P28482 1/20 0.65
MAOA P21397 1/20 0.55
CHRNB4 P30926 2/20 0.51
CHRNA3 P32297 2/20 0.51
CHRNA7 P36544 2/20 0.51
CHRNA10 Q9GZZ6 2/20 0.51
CHRNA9 Q9UGM1 2/20 0.51
HPGD P15428 3/20 0.50
MAPT P10636 2/20 0.50
HSD17B10 Q99714 2/20 0.50
ALDH1A1 P00352 2/20 0.50
ESR2 Q92731 1/20 0.50
LTA4H P09960 1/20 0.48
NQO1 P15559 1/20 0.46
S1PR1 P21453 1/20 0.46
AHR P35869 3/20 0.46
CMA1 P23946 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
SCHEMBL6626983 0.98 MEN1 (0.62) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL6626981 0.96 MEN1 (0.61) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL30301439 0.87 MEN1 (0.62) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL3790084 0.87 MAPK1 (0.62) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL3794904 0.87 MEN1 (0.62) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL1196091 0.85 LTA4H (0.55) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL16511229 0.84 APP (0.53) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL10045292 0.82 MEN1 (0.66) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL9983791 0.82 MAPK1 (0.66) MEN1KMT2APOLBMAPK1MAOA
SCHEMBL30041284 0.82 MAPK1 (0.66) MEN1KMT2APOLBMAPK1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232052-A Tetraindolylmethane compound and preparation method and application thereof 南京工业大学 2022-10-25 CN claimed
CN-114920684-B Selenium-containing benzamide compound and synthetic method and application thereof 浙江工业大学 2023-12-05 CN disclosed
CN-114736150-B off-DNA and on-DNA synthesis method of arylselenoindole compound 浙江工业大学 2023-03-31 CN disclosed
CN-115232052-A Tetraindolylmethane compound and preparation method and application thereof 南京工业大学 2022-10-25 CN disclosed
CN-114920684-A Selenium-containing benzamide compound and synthesis method and application thereof 浙江工业大学 2022-08-19 CN disclosed
CN-114736150-A off-DNA and on-DNA synthesis method of arylselenoindole compound 浙江工业大学 2022-07-12 CN disclosed
US-20210300912-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF Ikena Oncology, Inc. 2021-09-30 US disclosed
US-20210300912-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF Ikena Oncology, Inc. 2021-09-30 US disclosed
WO-2021127302-A1 2-(1H-INDOLE-3-CARBONYL)-THIAZOLE-4-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS FOR THE TREATMENT OF E.G. ANGIOGENESIS IMPLICATED OR INFLAMMATORY DISORDERS Ikena Oncology, Inc. (US) 2021-06-24 WO disclosed
WO-2018009539-A1 INHIBITORS OF HEXOKINASE AND METHODS OF USE THEREOF VTV THERAPEUTICS LLC (US) 2018-01-11 WO disclosed
US-20040048915-A1 Methods and compounds for treating proliferative diseases ENGLER THOMAS ALBERT (US) 2004-03-11 US disclosed
US-20040019097-A1 Method for producing trimer of indole derivative, and trimer of indole derivative and laminated structure thereof MITSUBISHI CHEMICAL CORPORATION (JP) 2004-01-29 US disclosed
US-20030207883-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2003-11-06 US disclosed
EP-1327632-A1 METHOD FOR PRODUCING TRIMER OF INDOLE DERIVATIVE, AND TRIMER OF INDOLE DERIVATIVE AND LAMINATED STRUCTURE THEREOF Mitsubishi Rayon Co., Ltd. (JP) 2003-07-16 EP disclosed
EP-1325011-A2 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES ELI LILLY AND COMPANY (US) 2003-07-09 EP disclosed
WO-2003004488-A1 INDAZOLE BENZIMIDAZOLE COMPOUNDS AS TYROSINE AND SERINE/THREONINE KINASE INHIBITORS CHIRON CORPORATION (US) 2003-01-16 WO disclosed
EP-0274825-B1 Indole derivatives and their uses in agriculture SYNGENTA LTD (GB) 2002-09-11 EP disclosed
WO-2002028861-A2 METHODS AND COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES ELI LILLY AND COMPANY (US) 2002-04-11 WO disclosed
US-4812162-A PLANT GROWTH REGULATORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-03-14 US disclosed
EP-0274825-A2 Indole derivatives and their uses in agriculture ZENECA LIMITED (GB) 1988-07-20 EP 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-20210300912-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 MEN1 4851/4885KMT2A 1031/4885POLB 3015/4885
US-20040048915-A1 Methods and compounds for treating proliferative diseases CDK4, CCNI, CCNA1 MEN1 2055/4885KMT2A 1627/4885POLB 142/4885
US-20040019097-A1 Method for producing trimer of indole derivative, and trimer of indole derivative and laminated structure thereof IDO1, IDO2, INMT MEN1 2605/4885KMT2A 2941/4885POLB 3660/4885
US-20030207883-A1 Indazole benzimidazole compounds SLCO1B3, SLCO1B1, SLCO4C1 MEN1 1653/4885KMT2A 3144/4885POLB 1795/4885

“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.