SCHEMBL31242898

SCHEMBL31242898

CC(=O)N1CCN(CC(=O)c2cnc(NC(=O)OC(C)(C)C)s2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 8/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
HDAC9 Q9UKV0 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
CCNB2 O95067 1/20 0.39
CCNE2 O96020 1/20 0.39
CDK1 P06493 1/20 0.39
CDK4 P11802 1/20 0.39
CCNB1 P14635 1/20 0.39
CCND1 P24385 1/20 0.39
CCNE1 P24864 1/20 0.39

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
SCHEMBL31242804 0.86 LMNA (0.43) OGASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL31242786 0.82 GRIN2B (0.38) OGASMN1; SMN2HDAC3HDAC4HDAC1
SCHEMBL31242853 0.79 KDR (0.38) OGASMN1; SMN2CCNB2CCNE2CDK1
SCHEMBL16753888 0.77 CCNE1 (0.43) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL15243996 0.77 KDM4E (0.38) OGASMN1; SMN2CCNB2CCNE2CDK1
SCHEMBL12715493 0.76 CCNE1 (0.50) SMN1; SMN2CCNB2CCNE2CDK1CDK4
SCHEMBL31242797 0.76 CCNE1 (0.43) SMN1; SMN2HDAC3HDAC4HDAC1HDAC7
SCHEMBL15725824 0.75 SMN1; SMN2 (0.46) SMN1; SMN2CCNB2CCNE2CDK1CDK4
SCHEMBL31242798 0.75 SMN1; SMN2 (0.43) SMN1; SMN2CCNB2CCNE2CDK1CDK4
SCHEMBL1131936 0.75 FFAR2 (0.48) SMN1; SMN2CCNB2CCNE2CDK1CDK4

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
EP-4711365-A1 THIAZOLE DERIVATIVE INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2026-03-18 EP disclosed
WO-2024235205-A1 THIAZOLE DERIVATIVE INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2024-11-21 WO disclosed