SCHEMBL7960674

SCHEMBL7960674

O=C(OCOC12CC3CC(CC(C3)C1)C2)C1C2C=CC(C2)C1C(=O)OCOC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CYP19A1 P11511 2/20 0.33
SCN9A Q15858 3/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
EPHX2 P34913 1/20 0.31
CYP17A1 P05093 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL11908877 0.80 ALDH1A1 (0.44) POLBALDH1A1HTTLMNANPSR1
SCHEMBL22263832 0.77 MEN1 (0.31) ALDH1A1HTTNPSR1MEN1KMT2A
SCHEMBL30210013 0.77 MEN1 (0.32) ALDH1A1HTTNPSR1MEN1KMT2A
SCHEMBL31248314 0.73 POLB (0.48) POLBALDH1A1SMN1; SMN2LMNANPSR1
SCHEMBL5837313 0.73 ALDH1A1 (0.50) POLBALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL2739904 0.73 ALDH1A1 (0.39) ALDH1A1HTTLMNANPSR1MEN1
SCHEMBL12149604 0.73 ALDH1A1 (0.55) POLBALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL12149652 0.72 ALDH1A1 (0.49) POLBALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL11908563 0.72 MEN1 (0.31) ALDH1A1HTTNPSR1MEN1KMT2A
SCHEMBL14648421 0.71 ALDH1A1 (0.50) ALDH1A1LMNANPSR1MEN1KMT2A

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
US-6270942-B1 PHOTOSENSITVE POLYMER CONTAINING NORBORNENE UNITS, MALEIC ANHYDRIDE UNITS AND UNSATURATED ESTER SAMSUNG ELECTRONICS CO., LTD (KR) 2001-08-07 US disclosed