SCHEMBL24736806

SCHEMBL24736806

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

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.36
▸ CNR2 P34972 4/20 0.36
▸ NR1H4 Q96RI1 1/20 0.35
▸ HSD11B1 P28845 4/20 0.32
▸ GRIN1 Q05586 2/20 0.32
▸ GRIN2B Q13224 2/20 0.32
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HDAC5 Q9UQL6 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ MGLL Q99685 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
SCHEMBL29721751 0.91 KIT (0.37) POLBHSD11B1GRIN1GRIN2BHDAC1
SCHEMBL24736769 0.91 KIT (0.37) POLBHSD11B1GRIN1GRIN2BHDAC1
SCHEMBL24736768 0.89 POLB (0.34) POLBHSD11B1GRIN1GRIN2B
SCHEMBL24737137 0.88 HSD11B1 (0.34) POLBHSD11B1GRIN1GRIN2BHDAC1
SCHEMBL31081668 0.87 KIT (0.35) POLB
SCHEMBL31081418 0.86 POLB (0.32) POLBHSD11B1
SCHEMBL24736825 0.84 KIT (0.37) POLBGRIN1GRIN2BHDAC1HDAC6
SCHEMBL29721702 0.83 LMNA (0.36) POLBGRIN1GRIN2BHDAC1HDAC6
SCHEMBL24736788 0.83 LMNA (0.36) POLBGRIN1GRIN2BHDAC1HDAC6
SCHEMBL18866344 0.82 POLB (0.42) POLBGRIN1GRIN2BHDAC1HDAC6

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 POLB 1781/4885CNR2 959/4885NR1H4 4384/4885

“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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