SCHEMBL24251363

SCHEMBL24251363

Cc1nn2c(C(C)C)c(C(=O)NC3CC(F)(F)C3)ccc2c1-c1c(F)cccc1F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SPR P35270 1/20 0.39
▸ KDM1A O60341 3/20 0.35
▸ HRH3 Q9Y5N1 2/20 0.35
▸ GRM4 Q14833 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ SCN10A Q9Y5Y9 1/20 0.34
▸ ABL1 P00519 1/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ PTGES O14684 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ ACSS2 Q9NR19 1/20 0.32
▸ CHRM4 P08173 1/20 0.32
▸ KIT P10721 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ DRD3 P35462 1/20 0.32
▸ TRPA1 O75762 1/20 0.31
▸ DHODH Q02127 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
SCHEMBL24251473 0.91 SCN9A (0.38) SPRHRH3SCN9ASCN10AKDM5A
SCHEMBL24251367 0.86 CSNK1E (0.37) —
SCHEMBL24251616 0.84 NPC1 (0.40) PTGESTYK2DHODH
SCHEMBL24251398 0.84 PBK (0.40) KDM5A
SCHEMBL24251395 0.83 MEN1 (0.40) HRH3KDM5AACSS2DRD2
SCHEMBL24251493 0.82 CHRM1 (0.42) —
SCHEMBL24251512 0.82 TAS1R3 (0.43) —
SCHEMBL23355438 0.80 PDE4B (0.35) SCN9ADHODH
SCHEMBL24251549 0.80 SPR (0.36) SPR
SCHEMBL23355480 0.79 KMT2A (0.37) SPR

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-20220048903-A1 Anthelminthic Heterocyclic Compounds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2022-02-17 — — 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-20220048903-A1 Anthelminthic Heterocyclic Compounds SDHA, PAH, PIGS SPR 4545/4885KDM1A 572/4885HRH3 169/4885

“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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