SCHEMBL23219684

SCHEMBL23219684

CCC(C)N1CCC(c2ccncc2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
TP53 P04637 4/20 0.42
PDE9A O76083 2/20 0.42
LMNA P02545 1/20 0.38
OPRM1 P35372 3/20 0.37
HRH3 Q9Y5N1 1/20 0.37
HSD11B1 P28845 1/20 0.37
ACACB O00763 1/20 0.36
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
MAP4K4 O95819 1/20 0.36
SPR P35270 1/20 0.36

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
SCHEMBL25000187 0.91 TP53 (0.47) DRD2TP53LMNAOPRM1HRH3
SCHEMBL12386859 0.84 DRD2 (0.55) DRD2DRD3PDE9AOPRM1HRH3
SCHEMBL12026532 0.84 PDE9A (0.45) DRD2DRD3TP53PDE9AHRH3
SCHEMBL25004309 0.81 DRD2 (0.44) DRD2DRD3HRH3
SCHEMBL10057674 0.77 HRH3 (0.49) TP53LMNAHRH3TLR9TLR8
SCHEMBL12946002 0.76 DRD2 (0.67) DRD2DRD3LMNAOPRM1
SCHEMBL19116791 0.76 DRD2 (0.45) DRD2DRD3HRH3
SCHEMBL14552934 0.75 DRD2 (0.62) DRD2DRD3PDE9AOPRM1
SCHEMBL13558661 0.74 OPRM1 (0.58) DRD2DRD3OPRM1HRH3
SCHEMBL25803076 0.74 TP53 (0.46) TP53PDE9ALMNAHRH3HSD11B1

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-10975088-B2 Imidazo[2,1-f][1,2,4]triazine compounds as pi3k-y inhibitors INCYTE CORPORATION (US) 2021-04-13 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-10975088-B2 Imidazo[2,1-f][1,2,4]triazine compounds as pi3k-y inhibitors PIK3R5, PIK3CD, PIK3CA DRD2 4186/4885DRD3 3934/4885TP53 1202/4885

“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.