SCHEMBL31234733

SCHEMBL31234733

COCCn1cc(OC2CCN(C(=O)C3CC3)C2)cn1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 13/20 0.42
▸ PIK3CA P42336 5/20 0.42
▸ PIK3CB P42338 3/20 0.42
▸ PIK3CG P48736 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ PIK3R1 P27986 3/20 0.42
▸ NAMPT P43490 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ BTK Q06187 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL31234220 0.82 ACACB (0.44) PIK3CDPIK3CAPIK3CBPIK3CGMAPT
SCHEMBL31234430 0.74 NAMPT (0.44) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL31234264 0.74 NAMPT (0.44) PIK3CDPIK3CAPIK3CBPIK3CGPIK3R1
SCHEMBL27228926 0.73 HMOX1 (0.35) MAPTNAMPT
SCHEMBL26988825 0.72 BTK (0.42) PIK3CDPIK3CANAMPTJAK2JAK1
SCHEMBL27115842 0.72 BTK (0.42) PIK3CDPIK3CANAMPTJAK2JAK1
SCHEMBL26907230 0.72 BTK (0.42) PIK3CDPIK3CANAMPTJAK2JAK1
SCHEMBL27229005 0.71 MAPT (0.34) PIK3CDPIK3CAPIK3CBPIK3CGMAPT
SCHEMBL27232182 0.71 MAPT (0.34) PIK3CDPIK3CAPIK3CBPIK3CGMAPT
SCHEMBL21193560 0.70 GRIN1 (0.47) NAMPTL3MBTL1LMNAKMT2A

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-20240390340-A1 PYRROLIDINE KRAS INHIBITORS INCYTE CORP (US) 2024-11-28 — — 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-20240390340-A1 PYRROLIDINE KRAS INHIBITORS KRAS, NRAS, HRAS PIK3CD 121/4885PIK3CA 40/4885PIK3CB 195/4885

“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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