SCHEMBL21553535

SCHEMBL21553535

CCSc1cc(C(=O)OC(C)(C)C)cnc1-c1nc2cc(SC(F)(F)F)ccc2o1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 3/20 0.33
▸ HDAC1 Q13547 3/20 0.33
▸ HDAC2 Q92769 3/20 0.33
▸ HDAC8 Q9BY41 3/20 0.33
▸ HDAC6 Q9UBN7 3/20 0.33
▸ MAPT P10636 9/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TP53 P04637 7/20 0.32
▸ POLB P06746 4/20 0.32
▸ RXFP1 Q9HBX9 4/20 0.32
▸ CEPT1 Q9Y6K0 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ UTRN P46939 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ THRB P10828 1/20 0.31
▸ CETP P11597 2/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ CASP3 P42574 1/20 0.30
▸ SENP8 Q96LD8 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
SCHEMBL23912586 0.87 HDAC6 (0.35) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL20867331 0.83 UTRN (0.32) MAPTTP53UTRNSMN1; SMN2RAB9A
SCHEMBL19942795 0.81 TP53 (0.34) MAPTTP53POLBRXFP1CEPT1
SCHEMBL25766299 0.81 TP53 (0.31) MAPTTP53POLBRXFP1KMT2A
SCHEMBL15846613 0.81 UTRN (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL29431610 0.81 UTRN (0.38) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL21051281 0.79 UTRN (0.33) UTRN
SCHEMBL20489570 0.79 UTRN (0.33) MAPTTP53POLBUTRNSMN1; SMN2
SCHEMBL29603696 0.79 UTRN (0.33) MAPTTP53POLBUTRNSMN1; SMN2
SCHEMBL19302014 0.78 HDAC3 (0.32) HDAC3HDAC1HDAC2HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110114354-B Condensed heterocyclic compound having oxime group or salt thereof, agricultural and horticultural insecticide containing the same, and method of using the same 日本农药株式会社 2022-04-29 — — CN disclosed
EP-3564238-B1 FUSED HETEROCYCLIC COMPOUND HAVING OXIME GROUP OR SALTS THEREOF, AGRICULTURAL/HORTICULTURAL INSECTICIDE CONTAINING SAID COMPOUNDS, AND METHOD FOR USING SAID INSECTICIDE NIHON NOHYAKU CO LTD (JP) 2021-10-13 — — EP disclosed
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
EP-3564238-A1 FUSED HETEROCYCLIC COMPOUND HAVING OXIME GROUP OR SALTS THEREOF, AGRICULTURAL/HORTICULTURAL INSECTICIDE CONTAINING SAID COMPOUNDS, AND METHOD FOR USING SAID INSECTICIDE Nihon Nohyaku Co., Ltd. (JP) 2019-11-06 — — 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-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 HDAC3 94/4885HDAC1 37/4885HDAC2 42/4885
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 HDAC3 94/4885HDAC1 37/4885HDAC2 42/4885

“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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