SCHEMBL29174941

SCHEMBL29174941

Cn1ncc2c(Cl)nc(C3CC3)nc21

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 10/20 0.47
PDE2A O00408 5/20 0.46
KMT2A Q03164 2/20 0.38
PDE8B O95263 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GAA P10253 1/20 0.37
CHRM3 P20309 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL30095656 1.00 PDE10A (0.47) PDE10APDE2AKMT2APDE8BKDM4E
SCHEMBL4698941 0.93 PDE2A (0.42) PDE10APDE2ACHRM3PDE4APDE4B
SCHEMBL31391497 0.83 PDE2A (0.46) PDE10APDE2AKMT2APDE8BALDH1A1
SCHEMBL25746321 0.83 PDE2A (0.46) PDE10APDE2AKMT2APDE8BALDH1A1
SCHEMBL29174759 0.83 PDE10A (0.43) PDE10APDE2A
SCHEMBL30095840 0.82 PDE2A (0.46) PDE2AKMT2APDE8BKDM4EALDH1A1
SCHEMBL29174903 0.82 PDE2A (0.46) PDE2AKMT2APDE8BKDM4EALDH1A1
SCHEMBL25875863 0.80 PDE2A (0.41) PDE10APDE2AALDH1A1GAAPDE4A
SCHEMBL30095904 0.80 PDE10A (0.43) PDE10APDE8B
SCHEMBL29174904 0.80 PDE10A (0.43) PDE10APDE8B

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-20240270750-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-08-15 US disclosed
CN-117529315-A Imidazole-containing ALK2 kinase inhibitors 生物水晶制药公司 2024-02-06 CN 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 PDE10A 822/4885PDE2A 370/4885KMT2A 906/4885

“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.