SCHEMBL4838653

SCHEMBL4838653

O=C(O)OC(=O)/C=C\C(=O)OC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
TSHR P16473 3/20 0.35
TP53 P04637 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.35
ALDH1A1 P00352 1/20 0.33
ATM Q13315 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL7568618 1.00 HCAR2 (0.42) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL26660918 0.97 HCAR2 (0.40) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL18784689 0.91 HCAR2 (0.55) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL18784690 0.91 HCAR2 (0.55) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL27550708 0.87 HCAR2 (0.32) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL28066038 0.82
SCHEMBL28320146 0.82
SCHEMBL27951533 0.80 TSHR (0.40) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL529629 0.80 TSHR (0.40) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL27951534 0.80 TSHR (0.40) HCAR2TSHRTP53EGLN1EGLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118325003-A High-salt-fog, high-hardness, high-gloss and high-water-resistance acrylic emulsion and preparation method thereof 广东衡光新材料科技有限公司 2024-07-12 CN claimed
CN-119662165-A Micro-crosslinking water-based binder for lithium ion battery, and preparation method and application thereof 卫星新材料研发有限公司 2025-03-21 CN disclosed
CN-119241782-A Antibacterial anti-adhesion functional emulsion and preparation method and application thereof 河南驼人医疗器械集团有限公司 2025-01-03 CN disclosed
CN-118325003-A High-salt-fog, high-hardness, high-gloss and high-water-resistance acrylic emulsion and preparation method thereof 广东衡光新材料科技有限公司 2024-07-12 CN disclosed
WO-2023167151-A1 BLOCK COPOLYMER, RESIN COMPOSITION, CURED PRODUCT, RESIN FILM, PREPREG, MULTILAYER BODY AND MATERIAL FOR ELECTRONIC CIRCUIT BOARDS 旭化成株式会社 2023-09-07 WO disclosed
WO-2023167152-A1 BLOCK COPOLYMER, RESIN COMPOSITION, CURED PRODUCT, RESIN FILM, PREPREG, MULTILAYER BODY AND MATERIAL FOR ELECTRONIC CIRCUIT BOARDS 旭化成株式会社 2023-09-07 WO disclosed
WO-2020162395-A1 ADHESIVE FILM AND METHOD FOR PRODUCING ADHESIVE FILM 三菱瓦斯化学株式会社 2020-08-13 WO disclosed
US-10669409-B2 Rubber composition and pneumatic tire including the same THE YOKOHAMA RUBBER CO., LTD. (JP) 2020-06-02 US disclosed
WO-2020031991-A1 PHOTOCURABLE ADHESIVE SHEET, ADHESIVE SHEET LAMINATE, LAMINATE FOR IMAGE DISPLAY DEVICE, AND IMAGE DISPLAY DEVICE 三菱ケミカル株式会社 2020-02-13 WO disclosed
CN-109294200-A A kind of preparation method of laminated silicate clay nano Composite polycarbonate material 宁波高新区诠宝绶新材料科技有限公司 2019-02-01 CN disclosed
EP-0663827-A1 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO. INC. (US) 1995-07-26 EP disclosed
WO-1995002607-A1 7-SUBSTITUTED-Δ4-6-AZASTEROID DERIVATIVES AS 5α-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1995-01-26 WO disclosed
WO-1995002587-A1 SUBSTITUTED PIPERAZINYLCAMPHOR DERIVATIVES AS OXYTOCIN ANTAGONISTS MERCK & CO., INC. (US) 1995-01-26 WO disclosed
WO-1994021614-A1 SUBSTITUTED 3-PHENANTHRIDINONE DERIVATIVES AS 5α-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1994-09-29 WO disclosed
WO-1994014438-A1 HYDANTOIN AND SUCCINIMIDE-SUBSTITUTED DERIVATIVES OF SPIROINDANYLCAMPHORSULFONYL OXYTOCIN ANTAGONISTS MERCK & CO., INC. (US) 1994-07-07 WO disclosed
WO-1994007496-A1 TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1994-04-14 WO disclosed
WO-1993006092-A1 PIPERAZINYL (SULFONYL)AMIDE DERIVATIVES OF CAMPHOR AS OXYTOCIN ANTAGONISTS MERCK & CO., INC. (US) 1993-04-01 WO disclosed
US-5137904-A Useful in the treatment of atherosclerosis and thrombosis G. D. SEARLE & CO. (US) 1992-08-11 US disclosed
EP-0486280-A2 Piperidinylcamphorsulfonyl oxytocin antagonists MERCK & CO. INC. (US) 1992-05-20 EP disclosed
WO-1992007821-A1 DIASTEREOISOMERS OF BICYCLO-SUBSTITUTED PHENYLACETONITRILE DERIVATIVES G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed