SCHEMBL24251599

SCHEMBL24251599

Cc1nn2c(C(C)C)c(C(=O)N[C@H]3CCc4ccc(F)cc43)ccc2c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.41
▸ PDE4A P27815 1/20 0.39
▸ PDE4B Q07343 1/20 0.39
▸ PDE4C Q08493 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ WDR5 P61964 5/20 0.39
▸ SCN9A Q15858 4/20 0.37
▸ CYP11B1 P15538 2/20 0.36
▸ CYP11B2 P19099 2/20 0.36
▸ CHRNB2 P17787 2/20 0.35
▸ CHRNB4 P30926 2/20 0.35
▸ CHRNA3 P32297 2/20 0.35
▸ CHRNA4 P43681 2/20 0.35
▸ APOB P04114 2/20 0.35
▸ MTTP P55157 2/20 0.35
▸ CCR2 P41597 1/20 0.35
▸ SCN5A Q14524 1/20 0.34

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
SCHEMBL24251550 0.90 PDE2A (0.42) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL24251414 0.87 HSD17B2 (0.38) SCN9ASCN5A
SCHEMBL24251390 0.86 PDE10A (0.43) PDE10AWDR5SCN9A
SCHEMBL24251594 0.81 HSD17B2 (0.40) CYP11B1CYP11B2CCR2
SCHEMBL24251444 0.78 TAS1R3 (0.44) PDE10A
SCHEMBL24251441 0.77 PDE2A (0.42) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL24251543 0.77 PDE10A (0.45) PDE10AWDR5
SCHEMBL24251374 0.77 TAS1R3 (0.49) PDE10A
SCHEMBL24251504 0.76 PDE10A (0.37) PDE10APDE4APDE4BPDE4CPDE4D
SCHEMBL24251396 0.73 TAS1R3 (0.48) PDE10A

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 PDE10A 1700/4885PDE4A 3002/4885PDE4B 2415/4885

“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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