SCHEMBL29375113

SCHEMBL29375113

COC(=O)c1ccc(N)c(N)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.72
MAPT P10636 10/20 0.72
ALDH1A1 P00352 9/20 0.72
HPGD P15428 8/20 0.72
GAA P10253 5/20 0.72
HSD17B10 Q99714 5/20 0.72
GLA P06280 1/20 0.72
CASP1 P29466 1/20 0.72
CASP7 P55210 1/20 0.72
ATM Q13315 1/20 0.72
USP2 O75604 1/20 0.60
NPC1 O15118 3/20 0.57
NPSR1 Q6W5P4 2/20 0.57
RAB9A P51151 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
CA12 O43570 2/20 0.57
CA7 P43166 2/20 0.57
CA9 Q16790 2/20 0.57

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
SCHEMBL192100 1.00 KDM4E (0.72) KDM4EMAPTALDH1A1HPGDGAA
Hydrochloric Acid SCHEMBL1223871 0.98 KDM4E (0.70) KDM4EMAPTALDH1A1HPGDGAA
Ammonia Solution, Strong SCHEMBL5311634 0.98 KDM4E (0.70) KDM4EMAPTALDH1A1HPGDGAA
Hydrochloric Acid SCHEMBL7251305 0.98 KDM4E (0.70) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL23226712 0.85 CA1 (0.56) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL753159 0.84 KDM4E (0.62) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL24412 0.84 CA12 (0.69) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL140666 0.84 CA12 (0.69) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL2912873 0.84 KDM4E (0.73) KDM4EMAPTALDH1A1HPGDGAA
SCHEMBL85805 0.84 MAPT (0.68) KDM4EMAPTALDH1A1HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116332779-B Preparation method of 3, 4-diaminomethyl benzoate 苏州敬业医药化工有限公司 2025-06-10 CN claimed
CN-119967648-A Far infrared carbon nanofiber membrane and preparation method thereof 太原理工大学 2025-05-09 CN claimed
CN-119874784-A Ruthenium complex and preparation method and application thereof 重庆市妇幼保健院(重庆市妇产科医院、重庆市遗传与生殖研究所) 2025-04-25 CN claimed
CN-119490731-A High-strength PET bottle blank and preparation method thereof 江西博特尔实业有限公司 2025-02-21 CN claimed
CN-118290987-A PCB (printed circuit board) inkjet printing anti-diffusion agent and preparation method and using method thereof 珠海市板明科技有限公司 2024-07-05 CN claimed
CN-116332779-A Preparation method of 3, 4-diaminomethyl benzoate 苏州敬业医药化工有限公司 2023-06-27 CN claimed
CN-115716734-A Anti-cracking corrosion-resistant type ultrahigh-performance concrete with thixotropy and preparation method thereof 深圳市海维科技研发有限责任公司 2023-02-28 CN claimed
CN-109289052-B Nitric oxide and cis-platinum targeted combined controllable drug delivery nano-drug system and preparation 华东理工大学 2022-02-08 CN claimed
CN-122036695-A Ionizable lipids, delivery vehicle compositions, drug delivery vehicles or drug/delivery vehicle complexes, pharmaceutical compositions or pharmaceutical formulations, and uses related to activating STING pathways 中国科学院上海药物研究所 2026-05-15 CN disclosed
CN-121471094-A Preparation method of 3, 4-diaminomethyl benzoate 济南尚博医药股份有限公司 2026-02-06 CN disclosed
CN-116332779-B Preparation method of 3, 4-diaminomethyl benzoate 苏州敬业医药化工有限公司 2025-06-10 CN disclosed
CN-120058618-A Antitumor cinnamyl piperazine and 2-phenylbenzimidazole conjugate, and preparation method and application thereof 天津科技大学 2025-05-30 CN disclosed
CN-119931014-A Application of nonmetallic organic compound in catalytic synthesis of polyester, polyester and preparation method thereof 青岛大学 2025-05-06 CN disclosed
CN-119874674-A GLP-1R modulating compounds 吉利德科学公司 2025-04-25 CN disclosed
EP-3990023-A1 BIS(2-HALOACETAMIDO)-COMPOUNDS FOR USE AS LINKING AGENTS AND RESULTANT PRODUCTS WHICH COMPRISE ANTIBODIES, HALF-ANTIBODIES AND ANTIBODY FRAGMENTS The University Of Bath (GB) 2022-05-04 EP disclosed
WO-2022083703-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY LHOTSE BIO, INC. (US) 2022-04-28 WO disclosed
CN-114269721-A Compounds for the treatment of respiratory diseases TMEM16A有限公司 2022-04-01 CN disclosed
CN-114230523-A Benzimidazole derivatives as modulators of ROR-gamma 生命医药有限责任公司 2022-03-25 CN disclosed
CN-114040915-A Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors 里伯赛恩斯有限责任公司 2022-02-11 CN disclosed
CN-109289052-B Nitric oxide and cis-platinum targeted combined controllable drug delivery nano-drug system and preparation 华东理工大学 2022-02-08 CN disclosed