SCHEMBL678961

SCHEMBL678961

COc1ccc(NC(C)=O)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.60
HSD17B1 P14061 1/20 0.57
HSD17B2 P37059 1/20 0.57
ALDH1A1 P00352 3/20 0.56
GAA P10253 3/20 0.56
NPC1 O15118 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KDM4E B2RXH2 1/20 0.56
MAPT P10636 1/20 0.56
LMNA P02545 1/20 0.55
TSHR P16473 1/20 0.55
HTT P42858 1/20 0.55
CA12 O43570 2/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA9 Q16790 2/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HPGD P15428 1/20 0.52
MTNR1A P48039 1/20 0.50

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
SCHEMBL29784735 1.00 RAB9A (0.60) RAB9AHSD17B1HSD17B2ALDH1A1GAA
SCHEMBL6117229 0.87 RAB9A (0.61) RAB9AALDH1A1GAANPC1KDM4E
SCHEMBL6371005 0.87 RAB9A (0.75) RAB9AALDH1A1GAANPC1SMN1; SMN2
SCHEMBL359701 0.86 MAPT (0.56) RAB9AHSD17B1HSD17B2ALDH1A1GAA
SCHEMBL11653044 0.86 RAB9A (0.60) RAB9AALDH1A1GAANPC1SMN1; SMN2
SCHEMBL16137281 0.84 EPHX1 (0.62) RAB9AALDH1A1GAASMN1; SMN2KDM4E
SCHEMBL5525112 0.84 RAB9A (0.62) RAB9AALDH1A1GAANPC1KDM4E
SCHEMBL1285510 0.84 KDM4E (0.54) RAB9AALDH1A1GAANPC1SMN1; SMN2
SCHEMBL28817127 0.83 ALDH1A1 (0.60) RAB9AALDH1A1GAANPC1KDM4E
SCHEMBL2191052 0.82 HSD17B1 (0.75) RAB9AHSD17B1HSD17B2ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101786956-B Method for deacylating N-acylated diphenylamine or ring-substituted derivatives thereof MORIS CHEMICAL CO LTD 2011-02-16 CN claimed
CN-101786956-A Method for deacylating N-acylated diphenylamine or ring-substituted derivatives thereof MORIS CHEMICAL CO LTD 2010-07-28 CN claimed
US-20230331710-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREOF SHANGHAI MEIYUE BIOTECH DEVELOPMENT CO. LTD (CN) 2023-10-19 US disclosed
US-20230331710-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREOF SHANGHAI MEIYUE BIOTECH DEVELOPMENT CO. LTD (CN) 2023-10-19 US disclosed
EP-4194449-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Meiyue Biotech Development Co., Ltd. (CN) 2023-06-14 EP disclosed
CN-108341774-B Substituted quinolinone inhibitors 首药控股(北京)股份有限公司 2022-07-19 CN disclosed
CN-107531685-B Compounds with antitumor activity AB科学有限公司 2021-04-23 CN disclosed
CN-108069868-B Method for preparing organic amide compound from aryl diazo tetrafluoroborate and nitrile 湖南理工学院 2020-11-13 CN disclosed
EP-2914575-B1 PLASMINOGEN ACTIVATOR-1 INHIBITORS AND METHODS OF USE THEREOF UNIV MICHIGAN REGENTS (US) 2020-10-14 EP disclosed
US-9867803-B2 IRE-1α inhibitors SHANGHAI FOSUN PHARMACEUTICAL INDUSTRIAL DEVELOPMENT CO. LTD. (CN) 2018-01-16 US disclosed
US-20170326104-A1 IRE-1ALPHA INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2017-11-16 US disclosed
WO-1997030035-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ZENECA LIMITED (GB) 1997-08-21 WO disclosed
EP-0276980-B1 CHROMOGENIC FLUORAN COMPOUNDS ESCO Company Limited Partnership (US) 1992-09-23 EP disclosed
US-4910183-A With an acidic developer APPLETON PAPERS INC. (US) 1990-03-20 US disclosed
US-4837210-A PRESSURE SENSITIVE OR HEAT SENSITIVE ELEMENTS APPLETON PAPERS INC. (US) 1989-06-06 US disclosed
EP-0276980-A2 Chromogenic fluoran compounds ESCO Company Limited Partnership (US) 1988-08-03 EP disclosed
US-4600797-A NITRATING AN AMINOBENZENE WHICH HAS A PROTECTEDD AMINO GROUP BAYER AKTIENGESELLSCHAFT (DE) 1986-07-15 US disclosed
EP-0049711-B1 PROCESS FOR THE PRODUCTION OF NITRO-AMINO-BENZENES BAYER AG (DE) 1984-02-29 EP disclosed
US-4330473-A FLUORAN COLOR-FORMER YAMAMOTO KAGAKU GOSEI KABUSHIKI KAISHA (JP) 1982-05-18 US disclosed
EP-0049711-A1 Process for the production of nitro-amino-benzenes BAYER AG (DE) 1982-04-21 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 (2 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-20230331710-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREOF C9, CFB, C5 RAB9A 2609/4885HSD17B1 458/4885HSD17B2 475/4885
US-20170326104-A1 IRE-1ALPHA INHIBITORS ERN1, XBP1, ERN2 RAB9A 1146/4885HSD17B1 1046/4885HSD17B2 1668/4885

“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.