SCHEMBL4736336

SCHEMBL4736336

CC1(C)CC[C@]2(COC(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)C(O)(O)C(C)(C)C5CC[C@]43C)[C@H]2C1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.58
PTPN2 P17706 7/20 0.56
PTPN6 P29350 2/20 0.56
AKR1B10 O60218 2/20 0.54
AKR1B1 P15121 2/20 0.54
PYGM P11217 1/20 0.51
GPBAR1 Q8TDU6 1/20 0.51

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
SCHEMBL4736769 0.86 PTPN1 (0.76) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL4735934 0.86 PTPN1 (0.76) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL4734341 0.85 PTPN1 (0.65) PTPN1PTPN2AKR1B10AKR1B1PYGM
SCHEMBL4736389 0.83 PTPN1 (0.73) PTPN1PTPN2AKR1B10AKR1B1PYGM
SCHEMBL5799378 0.83 PTPN1 (0.72) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL5795816 0.83 PTPN1 (0.72) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL5799434 0.83 PTPN1 (0.72) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL3291508 0.82 USP2 (0.70) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL2984032 0.81 PTPN1 (0.61) PTPN1PTPN2PTPN6AKR1B10AKR1B1
SCHEMBL4733506 0.78 PTPN1 (0.49) PTPN1PTPN2PTPN6AKR1B10AKR1B1

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-2008071169-A2 METHOD FOR THE PRODUCTION OF SPECIFIC INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE, IN PARTICULAR TYPE 1 WITH BASIC NOR-OLEANAN OR NOR-URSAN FRAMEWORKS UNIVERSITÄTSKLINIKUM SCHLESWIG-HOLSTEIN (DE) 2008-06-19 WO disclosed