SCHEMBL30009432

SCHEMBL30009432

C[C@H]1CCCCN1C(=O)c1cc(F)cc(F)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.69
▸ GAA P10253 2/20 0.69
▸ POLB P06746 1/20 0.58
▸ CA12 O43570 1/20 0.55
▸ CA1 P00915 1/20 0.55
▸ CA2 P00918 1/20 0.55
▸ CA7 P43166 1/20 0.55
▸ CA9 Q16790 1/20 0.55
▸ CA14 Q9ULX7 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ KMT2A Q03164 3/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ HSD11B1 P28845 1/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ TSHR P16473 1/20 0.45
▸ PDK2 Q15119 1/20 0.44

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
SCHEMBL27424708 0.85 HPGD (0.54) HPGDGAAPOLBCA12CA1
SCHEMBL16254905 0.84 GAA (0.84) HPGDGAAPOLBCA12CA1
SCHEMBL13761333 0.83 HPGD (0.51) HPGDGAAPOLBCA12CA1
SCHEMBL13753558 0.83 HPGD (0.51) HPGDGAAPOLBCA12CA1
SCHEMBL10720276 0.82 GAA (1.00) HPGDGAAPOLBCA12CA1
SCHEMBL31006695 0.81 MEN1 (0.49) HPGDGAAPOLBCA12CA1
SCHEMBL22054772 0.81 GAA (0.59) HPGDGAASMN1; SMN2KMT2AMEN1
SCHEMBL21697075 0.81 GAA (0.59) HPGDGAASMN1; SMN2KMT2AMEN1
SCHEMBL10723873 0.79 HPGD (0.76) HPGDGAACA12CA1CA2
SCHEMBL20370207 0.79 GAA (0.76) HPGDGAAPOLBCA12CA1

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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 — — 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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor MAP3K20, MAP3K15, MAP3K1 HPGD 2910/4885GAA 2187/4885POLB 4444/4885

“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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