SCHEMBL4879444

SCHEMBL4879444

Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C[C@@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)C(O)[Na])c2cc1C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.66
▸ NR3C1 P04150 1/20 0.66
▸ ADRB2 P07550 1/20 0.66
▸ HTR2C P28335 1/20 0.66
▸ ADRA1A P35348 1/20 0.66
▸ PTGS2 P35354 1/20 0.66
▸ MEN1 O00255 7/20 0.60
▸ KMT2A Q03164 7/20 0.60
▸ USP2 O75604 4/20 0.60
▸ HTT P42858 4/20 0.60
▸ HAT1 O14929 4/20 0.60
▸ RBBP7 Q16576 4/20 0.60
▸ KDM4E B2RXH2 3/20 0.60
▸ RECQL P46063 3/20 0.60
▸ CASP7 P55210 3/20 0.60
▸ MAPT P10636 3/20 0.60
▸ CASP1 P29466 2/20 0.60
▸ BRCA1 P38398 2/20 0.60
▸ HSD17B10 Q99714 2/20 0.60
▸ TST Q16762 2/20 0.60

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
SCHEMBL50097 0.89 MEN1 (0.74) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL6369069 0.88 MEN1 (0.73) ESR1NR3C1ADRB2HTR2CADRA1A
Water SCHEMBL2005233 0.88 MEN1 (0.72) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL4347661 0.85 MEN1 (0.79) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL24238132 0.84 ESR1 (0.78) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL16293291 0.83 ESR1 (0.77) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL2746656 0.83 ESR1 (0.75) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL10324834 0.81 MEN1 (0.70) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL50155 0.81 MEN1 (0.73) ESR1NR3C1ADRB2HTR2CADRA1A
SCHEMBL2244132 0.80 MEN1 (0.72) ESR1NR3C1ADRB2HTR2CADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118077774-A Formula milk powder capable of improving mineral absorption and preparation method thereof 内蒙古伊利实业集团股份有限公司 2024-05-28 — — CN claimed
US-11898955-B2 Devices, systems, and methods for agrochemical detection and agrochemical compositions SPOGEN BIOTECH INC. (US) 2024-02-13 — — US claimed
US-20230152217-A1 DEVICES, SYSTEMS, AND METHODS FOR AGROCHEMICAL DETECTION AND AGROCHEMICAL COMPOSITIONS SPOGEN BIOTECH INC. 2023-05-18 — — US claimed
CN-116035050-A Instant nutrition-balanced nutrition-enriched compressed biscuits and preparation method thereof 匹克国际贸易(天津)有限公司 2023-05-02 — — CN claimed
CN-115777938-A Health food for improving intestinal barrier 内蒙古伊利实业集团股份有限公司 2023-03-14 — — CN claimed
CN-113519850-A Tumor total nutrient emulsion, preparation method and application thereof 内蒙古蒙牛乳业(集团)股份有限公司 2021-10-22 — — CN claimed
CN-113116842-A Stomach retention tablet 广州玻思韬控释药业有限公司 2021-07-16 — — CN claimed
CN-113116851-A Stomach retention tablet 广州玻思韬控释药业有限公司 2021-07-16 — — CN claimed
CN-113116841-A Stomach retention tablet 广州玻思韬控释药业有限公司 2021-07-16 — — CN claimed
WO-2021136492-A1 GASTRIC RETENTION TABLET 广州玻思韬控释药业有限公司 2021-07-08 — — WO claimed
WO-2021136494-A1 GASTRIC RETENTION TABLET 广州玻思韬控释药业有限公司 2021-07-08 — — WO claimed
CN-112672745-A Folic acid compound preparation 阿普罗福尔公司 2021-04-16 — — CN claimed
CN-112021573-A Sports nutritional composition for improving endurance 上海轻姿健康管理有限公司 2020-12-04 — — CN claimed
EP-3625547-A1 DEVICES, SYSTEMS, AND METHODS FOR AGROCHEMICAL DETECTION AND AGROCHEMICAL COMPOSITIONS Spogen Biotech Inc. (US) 2020-03-25 — — EP claimed
CN-110638042-A Full-nutrition formula food and application thereof 光明乳业股份有限公司 2020-01-03 — — CN claimed
CN-110638043-A Full-nutrition formula food rich in probiotics as well as preparation method and application thereof 光明乳业股份有限公司 2020-01-03 — — CN claimed
WO-2018213596-A1 DEVICES, SYSTEMS, AND METHODS FOR AGROCHEMICAL DETECTION AND AGROCHEMICAL COMPOSITIONS SPOGEN BIOTECH INC. (US) 2018-11-22 — — WO claimed
CN-115067522-B Composition containing choline multiple vitamins and minerals, preparation method and application thereof 养生堂药业有限公司 2024-06-14 — — CN disclosed
WO-2016116281-A1 ANTIVIRAL AGENTS IMMUNOLOGIK GMBH (DE) 2016-07-28 — — WO disclosed
US-20080292613-A1 Food Supplement Based on Group B Vitamins, Trace Elements and -3 and/or 6- Fatty Acids and Use of This Food Supplement in the Simultaneous Treatment of Localized Cellulite and Slackening of the Skin LABORATOIRES EXPANSCIENCE 2008-11-27 — — US disclosed
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