SCHEMBL3384730

SCHEMBL3384730

Cn1nc(C(F)F)c(CO)c1Cl

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL14772989 0.83 NPSR1 (0.30)
SCHEMBL3381082 0.81
SCHEMBL18427002 0.79
SCHEMBL28473008 0.79
SCHEMBL28471960 0.79 P2RX7 (0.30)
SCHEMBL28471474 0.75
SCHEMBL28567284 0.74 PTGER4 (0.32)
SCHEMBL14923160 0.72 L3MBTL1 (0.30)
SCHEMBL844460 0.72 ALDH1A1 (0.44) KMT2AALDH1A1
SCHEMBL16373267 0.72

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591545-A Synthesis method of difluoro pyrazole acid and ester and intermediate thereof 湖北晟康化工有限公司 2025-03-11 CN disclosed
CN-112794846-B Ethyl isoxazoline derivative and application thereof 宁夏苏融达化工有限公司 2022-09-20 CN disclosed
US-11230529-B2 Method of preparing 3-fluoroalkyl-1 substituted pyrazol-4-carboxylic acid by air oxidation ABA CHEMICALS (NANTONG) LIMITED (CN) 2022-01-25 US disclosed
CN-112794846-A Ethyl isoxazoline derivative and application thereof 东莞市东阳光农药研发有限公司 2021-05-14 CN disclosed
CN-110511216-B Isoxazoline derivatives and their use in agriculture 东莞市东阳光农药研发有限公司 2020-09-11 CN disclosed
US-20170217900-A1 A METHOD OF PREPARING 3-FLUOROALKYL-1 SUBSTITUTED PYRAZOL-4-CARBOXYLIC ACID BY AIR OXIDATION ABA CHEMICALS (NANTONG) LIMITED (CN) 2017-08-03 US disclosed
EP-1364946-B1 ISOXAZOLINE DERIVATIVE AND HERBICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2010-11-24 EP disclosed
US-7833939-B2 Herbicide compositions KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-11-16 US disclosed
EP-2186410-A1 Isoxazoline derivative and herbicide comprising the same as active ingredient KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-05-19 EP disclosed
US-7238689-B2 Isoxazoline derivative and herbicide comprising the same as active ingredient IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-07-03 US disclosed
US-20050256004-A1 Herbicide compositions KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2005-11-17 US disclosed
US-20040110749-A1 Isoxazoline derivative and herbicide comprising the same as active ingredient KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2004-06-10 US disclosed
EP-1364946-A1 ISOXAZOLINE DERIVATIVE AND HERBICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2003-11-26 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 (4 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-20050256004-A1 Herbicide compositions DDT, CYP4X1, GLRX3 KMT2A 462/4885ALDH1A1 160/4885
US-11230529-B2 Method of preparing 3-fluoroalkyl-1 substituted pyrazol-4-carboxylic acid by air oxidation HAO2, AOX1, PPOX KMT2A 1425/4885ALDH1A1 85/4885
US-20170217900-A1 A METHOD OF PREPARING 3-FLUOROALKYL-1 SUBSTITUTED PYRAZOL-4-CARBOXYLIC ACID BY AIR OXIDATION HAO2, AOX1, PPOX KMT2A 1463/4885ALDH1A1 89/4885
US-20040110749-A1 Isoxazoline derivative and herbicide comprising the same as active ingredient CYP4X1, PRDX5, CYP3A7 KMT2A 1221/4885ALDH1A1 279/4885

“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.