SCHEMBL21919762

SCHEMBL21919762

CCS(=O)(=O)c1cc(/C(=N/O)OC)cnc1-c1nc2cc(SC(F)(F)F)ccc2o1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CEPT1 Q9Y6K0 1/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ UTRN P46939 4/20 0.32
▸ HDAC6 Q9UBN7 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ AHR P35869 1/20 0.32
▸ CETP P11597 1/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ POLB P06746 1/20 0.31
▸ HSPD1 P10809 2/20 0.31
▸ HSPE1 P61604 2/20 0.31
▸ HDAC3 O15379 1/20 0.30
▸ PTPN2 P17706 1/20 0.30
▸ PTPN1 P18031 1/20 0.30
▸ PTPN5 P54829 1/20 0.30
▸ MAPT P10636 2/20 0.30
▸ RXFP1 Q9HBX9 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
SCHEMBL21919003 0.90 UTRN (0.31) CEPT1SMN1; SMN2UTRN
SCHEMBL20489671 0.83 UTRN (0.35) CEPT1SMN1; SMN2UTRNHDAC6CYP1A2
SCHEMBL18758899 0.83 UTRN (0.33) CEPT1UTRNHDAC6CYP1A2AHR
SCHEMBL29603320 0.83 UTRN (0.35) CEPT1SMN1; SMN2UTRNHDAC6CYP1A2
SCHEMBL21810435 0.82 CYP1A2 (0.30) UTRNHDAC6CYP1A2AHR
SCHEMBL21525980 0.82 CYP1A2 (0.30) UTRNHDAC6CYP1A2AHR
SCHEMBL18760177 0.82 UTRN (0.35) CEPT1UTRNHDAC6CYP1A2AHR
SCHEMBL29603454 0.82 UTRN (0.35) CEPT1UTRNHDAC6CYP1A2AHR
SCHEMBL23120301 0.82 HSPD1 (0.36) CEPT1SMN1; SMN2UTRNHDAC6CYP1A2
SCHEMBL15858543 0.81 UTRN (0.38) UTRNHDAC6CYP1A2AHRCETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10856548-B2 Oxime group-containing condensed heterocyclic compound or salt thereof, agricultural and horticultural insecticide comprising the compound or the salt, and method for using the insecticide NIHON NOHYAKU CO., LTD. (JP) 2020-12-08 — — US disclosed
US-20200085054-A1 OXIME GROUP-CONTAINING CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND OR THE SALT, AND METHOD FOR USING THE INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 2020-03-19 — — US 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-20200085054-A1 OXIME GROUP-CONTAINING CONDENSED HETEROCYCLIC COMPOUND OR SALT THEREOF, AGRICULTURAL AND HORTICULTURAL INSECTICIDE COMPRISING THE COMPOUND OR THE SALT, AND METHOD FOR USING THE INSECTICIDE OXSR1, CBR3, OSR1 CEPT1 1548/4885SMN1; SMN2 3550/4885UTRN 4859/4885
US-10856548-B2 Oxime group-containing condensed heterocyclic compound or salt thereof, agricultural and horticultural insecticide comprising the compound or the salt, and method for using the insecticide OXSR1, CBR3, OSR1 CEPT1 1548/4885SMN1; SMN2 3550/4885UTRN 4859/4885

“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.

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