SCHEMBL22173643

SCHEMBL22173643

O=C(CCl)Nc1cc(Cl)ccc1OC(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
ALDH1A1 P00352 7/20 0.51
GSTO1 P78417 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
HTT P42858 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
MITF O75030 1/20 0.47
THRB P10828 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
GAA P10253 1/20 0.46
POLB P06746 2/20 0.46
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
CNR2 P34972 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL30663604 1.00 KMT2A (0.55) KMT2AMEN1ALDH1A1GSTO1SMN1; SMN2
SCHEMBL18579521 0.84 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1GSTO1SMN1; SMN2
SCHEMBL17101064 0.84 KDR (0.49) ALDH1A1GSTO1SMN1; SMN2HTTCYP1A2
SCHEMBL22173614 0.83 MEN1 (0.52) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL16098600 0.83 GSTO1 (0.48) KMT2AALDH1A1GSTO1KDM4ENPC1
SCHEMBL23466432 0.81 GPR35 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL18751323 0.81 KMT2A (0.50) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL29678574 0.81 GAA (0.50) KMT2AMEN1ALDH1A1GSTO1KDM4E
SCHEMBL9468747 0.81 KMT2A (0.82) KMT2AMEN1ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL5904019 0.81 GAA (0.50) KMT2AMEN1ALDH1A1GSTO1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113194721-B Pesticidal compositions and methods 科迪华农业科技有限责任公司 2024-03-01 CN disclosed
CN-113347883-B Pesticidal compositions and methods 科迪华农业科技有限责任公司 2023-11-03 CN disclosed
US-11332452-B2 Pesticidal compositions and methods CORTEVA AGRISCIENCE LLC (US) 2022-05-17 US disclosed
US-11297838-B2 Pesticidal compositions and methods CORTEVA AGRISCIENCE LLC (US) 2022-04-12 US disclosed
US-20210282402-A1 PESTICIDAL COMPOSITIONS AND METHODS DOW AGROSCIENCES LLC (US) 2021-09-16 US disclosed
US-20210276963-A1 PESTICIDAL COMPOSITIONS AND METHODS DOW AGROSCIENCES LLC (US) 2021-09-09 US disclosed
CN-113347883-A Pesticidal compositions and methods 科迪华农业科技有限责任公司 2021-09-03 CN disclosed
CN-113194721-A Pesticidal compositions and methods 科迪华农业科技有限责任公司 2021-07-30 CN disclosed
WO-2020163146-A1 PESTICIDAL COMPOSITIONS AND METHODS DOW AGROSCIENCES LLC (US) 2020-08-13 WO disclosed
WO-2020139566-A1 PESTICIDAL COMPOSITIONS AND METHODS DOW AGROSCIENCES LLC (US) 2020-07-02 WO 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-11297838-B2 Pesticidal compositions and methods ACHE, DDT, PLA2G2D KMT2A 1768/4885MEN1 1670/4885ALDH1A1 762/4885
US-20210276963-A1 PESTICIDAL COMPOSITIONS AND METHODS ACHE, DDT, PLA2G2D KMT2A 1768/4885MEN1 1670/4885ALDH1A1 762/4885
US-11332452-B2 Pesticidal compositions and methods ACHE, DDT, PLA2G2D KMT2A 1768/4885MEN1 1670/4885ALDH1A1 762/4885
US-20210282402-A1 PESTICIDAL COMPOSITIONS AND METHODS ACHE, DDT, PLA2G2D KMT2A 1768/4885MEN1 1670/4885ALDH1A1 762/4885

“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.