SCHEMBL30009820

SCHEMBL30009820

O=C(Nc1ccc2cc[nH]c2n1)C1CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.57
▸ ABL1 P00519 3/20 0.52
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ ADORA2B P29275 2/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ ADORA1 P30542 1/20 0.47
▸ JAK1 P23458 11/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.44
▸ L3MBTL1 Q9Y468 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
SCHEMBL29697316 0.82 ROCK2 (0.51) HPGDABL1NPC1RAB9A
SCHEMBL30597964 0.81 SMN1; SMN2 (0.49) HPGDABL1NPC1RAB9AJAK1
SCHEMBL21874330 0.80 APP (0.41) HPGDNPC1RAB9A
SCHEMBL30597983 0.78 SLC5A1 (0.39) HPGDABL1
SCHEMBL30009349 0.77 ABL1 (0.52) HPGDABL1ADORA2AADORA1JAK1
SCHEMBL30597949 0.77 SLC5A1 (0.39) HPGDABL1NPC1RAB9AJAK1
SCHEMBL21961535 0.77 CTSC (0.38) HPGDABL1NPC1RAB9AJAK1
SCHEMBL4342923 0.75 JAK3 (0.41) HPGDABL1JAK1
SCHEMBL25348919 0.75 GSK3A (0.53) ABL1JAK1
SCHEMBL29513948 0.75 GSK3A (0.53) ABL1JAK1

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 2 patents. 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 claimed
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 2910/4885ABL1 230/4885NPC1 1715/4885

“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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