SCHEMBL24736769

SCHEMBL24736769

CCS(=O)(=O)c1cc(-c2noc(C3(C(F)(F)F)CC3)n2)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ HSD11B1 P28845 4/20 0.31
▸ GRIN1 Q05586 2/20 0.31
▸ GRIN2B Q13224 2/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HDAC5 Q9UQL6 1/20 0.31

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
SCHEMBL29721751 1.00 KIT (0.37) KITPOLBHSD11B1GRIN1GRIN2B
SCHEMBL31081668 0.95 KIT (0.35) KITPOLB
SCHEMBL24736806 0.91 POLB (0.36) POLBHSD11B1GRIN1GRIN2BHDAC1
SCHEMBL31081732 0.89 KIT (0.37) KIT
SCHEMBL24736768 0.89 POLB (0.34) POLBHSD11B1GRIN1GRIN2B
SCHEMBL24736792 0.88 KIT (0.36) KITHSD11B1GRIN1GRIN2BHDAC1
SCHEMBL24737137 0.87 HSD11B1 (0.34) KITPOLBHSD11B1GRIN1GRIN2B
SCHEMBL31081527 0.87 KIT (0.35) KITHSD11B1
SCHEMBL31081418 0.85 POLB (0.32) POLBHSD11B1
SCHEMBL31081810 0.85 KIT (0.36) KITHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220361499-A1 AGRICULTURAL OR HORTICULTURAL INSECTICIDE OR ANIMAL ECTOPARASITE OR ENDOPARASITE CONTROL AGENT EACH COMPRISING A CONDENSED HETEROCYCLIC COMPOUND HAVING A SUBSTITUTED CYCLOPROPANE-OXADIAZOLE GROUP OR A SALT THEREOF AS ACTIVE INGREDIENT, AND METHOD FOR USING THE INSECTICIDE OR THE CONTROL AGENT NIHON NOHYAKU CO., LTD. (JP) 2022-11-17 — — 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 (1 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-20220361499-A1 AGRICULTURAL OR HORTICULTURAL INSECTICIDE OR ANIMAL ECTOPARASITE OR ENDOPARASITE CONTROL AGENT EACH COMPRISING A CONDENSED HETEROCYCLIC COMPOUND HAVING A SUBSTITUTED CYCLOPROPANE-OXADIAZOLE GROUP OR A SALT THEREOF AS ACTIVE INGREDIENT, AND METHOD FOR USING THE INSECTICIDE OR THE CONTROL AGENT H1-3, H1-0, CBR3 KIT 4123/4885POLB 1781/4885HSD11B1 206/4885

“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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