SCHEMBL537622

SCHEMBL537622

Cn1nc(C(F)(F)F)c(CO)c1OC(F)F

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
CYP3A4 P08684 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
GAA P10253 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL537532 0.88 SMN1; SMN2 (0.35) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL5378880 0.86 ALOX5AP (0.39) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL34467245 0.84 CYP1A2 (0.34) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL5388686 0.84 CYP1A2 (0.32) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL1028460 0.84 ALOX5AP (0.32) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL5378099 0.84 MEN1 (0.32) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL26103877 0.83 MEN1 (0.33) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL537606 0.82 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL537595 0.79 SMN1; SMN2 (0.38) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL4173041 0.79 SMN1; SMN2 (0.36) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410138-B Pyricularia sulfone Synthesis method of intermediate 山东润博生物科技有限公司 2025-05-06 CN claimed
CN-118255757-B Continuous synthesis method of pyribenzoxim 吉林凯莱英医药化学有限公司 2024-09-27 CN claimed
CN-118255757-A Continuous synthesis method of pyribenzoxim 吉林凯莱英医药化学有限公司 2024-06-28 CN claimed
CN-116410138-A Synthesis method of topiramate intermediate 山东润博生物科技有限公司 2023-07-11 CN claimed
CN-116410138-B Pyricularia sulfone Synthesis method of intermediate 山东润博生物科技有限公司 2025-05-06 CN disclosed
CN-116410138-B Pyricularia sulfone Synthesis method of intermediate 山东润博生物科技有限公司 2025-05-06 CN disclosed
CN-119504590-A 1-Methyl-3-trifluoromethyl-4-chloromethyl-5-difluoromethoxy-1-H-pyrazole and preparation method thereof 鹤壁市宝瑞德化工有限公司 2025-02-25 CN disclosed
EP-4488274-A2 HERBICIDE AND PRODUCTION METHOD FOR INTERMEDIATE THEREOF Kumiai Chemical Industry Co., Ltd. (JP) 2025-01-08 EP disclosed
EP-4053125-B1 PROCESS FOR THE PRODUCTION OF A PYROXASULFONE HERBICIDE KUMIAI CHEMICAL INDUSTRY CO (JP) 2024-12-04 EP disclosed
US-20240391909-A1 DISULFIDE COMPOUND, POLYSULFIDE COMPOUND, AND USE THEREOF KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2024-11-28 US disclosed
CN-118255757-B Continuous synthesis method of pyribenzoxim 吉林凯莱英医药化学有限公司 2024-09-27 CN disclosed
EP-4424672-A1 DISULFIDE COMPOUND, POLYSULFIDE COMPOUND, AND USE THEREOF Kumiai Chemical Industry Co., Ltd. (JP) 2024-09-04 EP disclosed
CN-112969697-A Process for producing herbicide and intermediate thereof 组合化学工业株式会社 2021-06-15 CN disclosed
WO-2021002484-A9 HERBICIDE AND PRODUCTION METHOD FOR INTERMEDIATE THEREOF クミアイ化学工業株式会社 2021-04-15 WO disclosed
WO-2021002484-A2 HERBICIDE AND PRODUCTION METHOD FOR INTERMEDIATE THEREOF クミアイ化学工業株式会社 2021-01-07 WO disclosed
WO-2020240392-A1 PROCESS FOR PREPARATION OF PYROXASULFONE PI INDUSTRIES LIMITED (IN) 2020-12-03 WO disclosed
EP-1990336-B1 PROCESS FOR PRODUCTION OF 5-ALKOXY-4-HYDROXYMETHYLPYRAZOLE COMPOUND IHARA CHEMICAL IND CO (JP) 2012-02-08 EP disclosed
US-7812175-B2 Process for production of 5-alkoxy-4-hydroxymethylpyrazole compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2010-10-12 US disclosed
US-20090036688-A1 Process for Production of 5-Alkoxy-4-Hydroxymethylpyrazole Compound IHARA CHEMICAL INDUSTRY CO., LTD (JP) 2009-02-05 US disclosed
EP-1990336-A1 PROCESS FOR PRODUCTION OF 5-ALKOXY-4-HYDROXYMETHYLPYRAZOLE COMPOUND Ihara Chemical Industry Co., Ltd. (JP) 2008-11-12 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-20090036688-A1 Process for Production of 5-Alkoxy-4-Hydroxymethylpyrazole Compound CYP4F3, ADH5, CYP3A4 SMN1; SMN2 4556/4885MEN1 3184/4885KMT2A 841/4885
US-20240391909-A1 DISULFIDE COMPOUND, POLYSULFIDE COMPOUND, AND USE THEREOF STS, SQOR, PRDX2 SMN1; SMN2 1285/4885MEN1 3320/4885KMT2A 1102/4885

“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.