SCHEMBL9218487

SCHEMBL9218487

CCC(C)n1c(=O)cc(C)[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.39
EZH2 Q15910 1/20 0.36
ALDH1A1 P00352 3/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2B6 P20813 1/20 0.34
GAA P10253 1/20 0.33
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA3 P42263 1/20 0.32
GRIA4 P48058 1/20 0.32
SHMT2 P34897 1/20 0.32
HPGD P15428 3/20 0.32
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
GFER P55789 1/20 0.32
POLB P06746 1/20 0.32
PKM P14618 2/20 0.31
CA1 P00915 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL30825575 0.98 SMN1; SMN2 (0.38) SMN1; SMN2EZH2ALDH1A1CYP3A4CYP2B6
SCHEMBL16321589 0.81 KMT2A (0.41) SMN1; SMN2ALDH1A1CYP3A4CYP2B6GAA
SCHEMBL16321588 0.81 KMT2A (0.41) SMN1; SMN2ALDH1A1CYP3A4CYP2B6GAA
SCHEMBL24171772 0.77 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL9218473 0.75 TYMP (0.38) SMN1; SMN2ALDH1A1GAASHMT2KDM4E
SCHEMBL28339794 0.73 CA1 (0.46) SMN1; SMN2EZH2ALDH1A1PKMCA1
SCHEMBL18171770 0.71 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1CYP3A4CYP2B6HPGD
SCHEMBL4770756 0.71 CYP3A4 (0.50) SMN1; SMN2ALDH1A1CYP3A4CYP2B6HPGD
SCHEMBL24313029 0.70 CYP3A4 (0.48) SMN1; SMN2CYP3A4CYP2B6HTT
SCHEMBL4771370 0.69 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1CYP3A4GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114656408-B Synthesis process of plant protective agent intermediate 药源药物化学(上海)有限公司 2024-09-06 CN claimed
CN-114656408-A Synthetic process of plant protectant intermediate 药源药物化学(上海)有限公司 2022-06-24 CN claimed
CN-110612119-A Phospholipid ether (PLE) CAR T cell tumor targeting (CTCT) agents 西雅图儿童医院(DBA西雅图儿童研究所) 2019-12-24 CN claimed
WO-2018148224-A1 PHOSPHOLIPID ETHER (PLE) CAR T CELL TUMOR TARGETING (CTCT) AGENTS Seattle Children's Hospital (dba Seattle Children's Research Institute) (US) 2018-08-16 WO claimed
CN-103012286-A Synthetic process of herbicide ZHANG WANYING 2013-04-03 CN claimed
CN-101402609-A Method for synthesis of 5-bromine-3-sec-butyl-6- methyl uracil YIYUAN XINQUAN CHEMICAL CO LTD (CN) 2009-04-08 CN claimed
CN-119866331-A Process for preparing brominated uracil derivatives 安道麦阿甘有限公司 2025-04-22 CN disclosed
CN-110612119-B Phosphatidylether (PLE) CAR T cell tumor targeting (CTCT) agents 西雅图儿童医院(DBA西雅图儿童研究所) 2024-10-29 CN disclosed
CN-114656408-B Synthesis process of plant protective agent intermediate 药源药物化学(上海)有限公司 2024-09-06 CN disclosed
CN-114656408-B Synthesis process of plant protective agent intermediate 药源药物化学(上海)有限公司 2024-09-06 CN disclosed
US-20240226160-A9 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN SEATTLE CHILDREN'S HOSPITAL D/B/A SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2024-07-11 US disclosed
US-20240131072-A1 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN SEATTLE CHILDREN'S HOSPITAL D/B/A SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2024-04-25 US disclosed
WO-2024062479-A1 A PROCESS FOR PREPARING BROMINATED URACIL DERIVATIVES ADAMA AGAN LTD. (IL) 2024-03-28 WO disclosed
EP-0104876-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1991-12-27 EP disclosed
EP-0209283-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1991-10-16 EP disclosed
EP-0176294-B1 CYCLOHEXANE-1,3-DIONE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PROCESSES FOR PREPARING THEM, AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS ICI AUSTRALIA LIMITED (AU) 1991-06-05 EP disclosed
EP-0124992-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1991-05-29 EP disclosed
EP-0211605-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1991-05-15 EP disclosed
EP-0125094-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1991-04-24 EP disclosed
EP-0125059-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1991-02-27 EP disclosed