SCHEMBL26394149

SCHEMBL26394149

N#Cc1ccc(Cl)c(-c2ccc3[nH]nc(NC(=O)C4CCNCC4)c3c2)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 11/20 0.46
▸ GSK3A P49840 10/20 0.46
▸ AAK1 Q2M2I8 6/20 0.46
▸ CDK2 P24941 4/20 0.46
▸ ULK1 O75385 2/20 0.46
▸ PIK3CD O00329 1/20 0.46
▸ PIM1 P11309 1/20 0.46
▸ SGK1 O00141 1/20 0.43

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
Hydrochloric Acid SCHEMBL26132206 0.99 GSK3B (0.45) GSK3BGSK3AAAK1CDK2ULK1
Hydrochloric Acid SCHEMBL26132402 0.94 ULK1 (0.43) GSK3BGSK3AAAK1CDK2ULK1
SCHEMBL26395004 0.90 GSK3B (0.47) GSK3BGSK3AAAK1CDK2PIK3CD
SCHEMBL26396727 0.90 ULK1 (0.50) GSK3BGSK3AAAK1CDK2ULK1
SCHEMBL26396855 0.90 ULK1 (0.50) GSK3BGSK3AAAK1CDK2ULK1
SCHEMBL26396767 0.90 ULK1 (0.50) GSK3BGSK3AAAK1CDK2ULK1
Hydrochloric Acid SCHEMBL26128155 0.89 ULK1 (0.49) GSK3BGSK3AAAK1CDK2ULK1
Hydrochloric Acid SCHEMBL26132658 0.89 ULK1 (0.49) GSK3BGSK3AAAK1CDK2ULK1
Hydrochloric Acid SCHEMBL26129238 0.89 ULK1 (0.49) GSK3BGSK3AAAK1CDK2ULK1
SCHEMBL26396503 0.89 GSK3B (0.41) GSK3BGSK3AAAK1CDK2PIK3CD

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
WO-2023186773-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2023-10-05 — — WO disclosed
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