SCHEMBL29174858

SCHEMBL29174858

CC(C)c1cnn2c(=O)[nH]c(C3CC3)nc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 1/20 0.51
▸ TYK2 P29597 1/20 0.41
▸ ADORA1 P30542 4/20 0.36
▸ ADORA2A P29274 4/20 0.35
▸ ADORA2B P29275 4/20 0.35
▸ ADORA3 P0DMS8 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CDK2 P24941 5/20 0.34
▸ CDK7 P50613 4/20 0.34
▸ CCNH P51946 4/20 0.34
▸ MNAT1 P51948 4/20 0.34
▸ CCNE1 P24864 3/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ PDE2A O00408 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
SCHEMBL23529884 0.78 XDH (0.36) CDK2CDK7CCNHMNAT1CCNE1
SCHEMBL18510365 0.77 CDK7 (0.34) CDK2CDK7CCNHMNAT1CCNE1
SCHEMBL24408250 0.77 HAVCR2 (0.35) CDK2CDK7CCNHMNAT1CCNE1
SCHEMBL15224509 0.74 LMNA (0.36) LMNACDK2CDK7CCNHMNAT1
SCHEMBL21741564 0.73 CDK2 (0.39) CDK2CDK7CCNHMNAT1CCNE1
SCHEMBL29174908 0.69 CDK2 (0.36) CDK2CDK7CCNHMNAT1CCNE1
SCHEMBL29174808 0.68 ALDH1A1 (0.41) MAPK1SMN1; SMN2CDK2CDK7CCNH
SCHEMBL29174891 0.68 ALDH1A1 (0.44) LMNAMAPK1SMN1; SMN2CDK2CDK7
SCHEMBL18520998 0.67 ALDH1A1 (0.39) ADORA1ADORA2AADORA2BADORA3CYP1A2
SCHEMBL24236930 0.67 HTR2C (0.31) HTR2C

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240270750-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-08-15 — — US disclosed
EP-4346806-A2 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE Biocryst Pharmaceuticals, Inc. (US) 2024-04-10 — — EP disclosed
CN-117529315-A Imidazole-containing ALK2 kinase inhibitors 生物水晶制药公司 2024-02-06 — — CN disclosed
WO-2022251188-A2 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE BIOCRYST PHARMACEUTICALS, INC. (US) 2022-12-01 — — WO 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-20240270750-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE ALK, ACVR2B, ACVR2A HTR2C 3935/4885TYK2 205/4885ADORA1 3027/4885

“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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