SCHEMBL26484666

SCHEMBL26484666

COc1cc(C)ccc1N1CCC(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SUV39H2 Q9H5I1 14/20 0.50
CKS1B P61024 1/20 0.47
SKP1 P63208 1/20 0.47
SKP2 Q13309 1/20 0.47
KDM4D Q6B0I6 2/20 0.46
CFTR P13569 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL20149913 0.91 SUV39H2 (0.48) SUV39H2CKS1BSKP1SKP2KDM4D
SCHEMBL38659211 0.86 KDM4E (0.49) SUV39H2CKS1BSKP1SKP2KDM4D
SCHEMBL15759214 0.85 CKS1B (0.47) CKS1BSKP1SKP2KDM4D
SCHEMBL4442557 0.85 CKS1B (0.47) CKS1BSKP1SKP2NPC1RAB9A
SCHEMBL20133857 0.84 DRD2 (0.60) SUV39H2CKS1BSKP1SKP2
SCHEMBL4443945 0.82 CKS1B (0.47) CKS1BSKP1SKP2
SCHEMBL12283995 0.81 SUV39H2 (0.49) SUV39H2KDM4D
SCHEMBL4433773 0.81 MAPT (0.50) CKS1BSKP1SKP2
SCHEMBL12069190 0.80 CKS1B (0.45) SUV39H2CKS1BSKP1SKP2
SCHEMBL517675 0.80 SUV39H2 (0.45) SUV39H2CKS1BSKP1SKP2KDM4D

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-2023075479-A1 NOVEL THIENO[2,3-D]PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER OR AUTOIMMUNE DISEASE COMPRISING SAME AS ACTIVE INGREDIENT 재단법인 대구경북첨단의료산업진흥재단 2023-05-04 WO disclosed