SCHEMBL25344739

SCHEMBL25344739

COc1ccccc1-c1c[nH]c2nc(NC(=O)C3CC3)ccc12

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.56
GSK3A P49840 1/20 0.56
MAPK14 Q16539 2/20 0.51
JAK1 P23458 5/20 0.49
JAK2 O60674 2/20 0.45
TYK2 P29597 2/20 0.45
CDK9 P50750 1/20 0.45
ABL1 P00519 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PTK2 Q05397 1/20 0.42

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
SCHEMBL29513749 1.00 GSK3B (0.56) GSK3BGSK3AMAPK14JAK1JAK2
SCHEMBL25347311 0.89 GSK3B (0.48) GSK3BGSK3AMAPK14JAK1JAK2
SCHEMBL29514309 0.89 GSK3B (0.48) GSK3BGSK3AMAPK14JAK1JAK2
SCHEMBL29513809 0.87 MAP4K1 (0.44) GSK3BGSK3AMAPK14ABL1
SCHEMBL25346743 0.87 MAP4K1 (0.44) GSK3BGSK3AMAPK14ABL1
SCHEMBL29513655 0.87 MAP4K1 (0.44) GSK3BGSK3AMAPK14ABL1
SCHEMBL25347848 0.87 MAP4K1 (0.44) GSK3BGSK3AMAPK14ABL1
SCHEMBL25346233 0.86 GSK3B (0.43) GSK3BGSK3AMAPK14JAK1ABL1
SCHEMBL29513718 0.86 GSK3B (0.43) GSK3BGSK3AMAPK14JAK1ABL1
SCHEMBL25346785 0.86 LMNA (0.42) GSK3BGSK3AMAPK14JAK1ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043420-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES ENLIVEN INC. 2024-02-08 US disclosed
EP-4225741-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES Enliven Therapeutics, Inc. (US) 2023-08-16 EP disclosed
CN-116438182-A 7-azaindole compounds for inhibiting BCR-ABL tyrosine kinase 活力疗法公司 2023-07-14 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-20240043420-A1 7-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES ABL1, ABL2, BCR GSK3B 669/4885GSK3A 670/4885MAPK14 627/4885

“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.