SCHEMBL584437

SCHEMBL584437

CCOC(=O)C1C2CC(C(=O)OCc3ccccc3)CC21

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.49
FABP5 Q01469 1/20 0.49
HPGD P15428 1/20 0.47
PKM P14618 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 4/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
MAPT P10636 1/20 0.45
EGFR P00533 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 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
SCHEMBL15447425 1.00 FABP7 (0.49) FABP7FABP5HPGDPKMNPSR1
SCHEMBL20489039 0.83 FABP7 (0.43) FABP7FABP5PKMNPSR1ALDH1A1
SCHEMBL31184747 0.82 MAPT (0.56) HPGDALDH1A1MAPTL3MBTL1HSD17B10
SCHEMBL17390980 0.82 ALDH1A1 (0.60) FABP7FABP5HPGDALDH1A1L3MBTL1
SCHEMBL17390977 0.82 ALDH1A1 (0.60) FABP7FABP5HPGDALDH1A1L3MBTL1
SCHEMBL9002126 0.82 ALDH1A1 (0.60) FABP7FABP5HPGDALDH1A1L3MBTL1
SCHEMBL17391194 0.82 ALDH1A1 (0.60) FABP7FABP5HPGDALDH1A1L3MBTL1
SCHEMBL19323426 0.82 CA1 (0.63) FABP7FABP5NPSR1ALDH1A1CA1
SCHEMBL31184719 0.82 ALDH1A1 (0.54) ALDH1A1CA1CA2
SCHEMBL34472430 0.82 ALDH1A1 (0.54) ALDH1A1CA1CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059577-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS FOR USE AS AKT1 INHIBITORS ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed
EP-2417128-A2 6-(3-AZA-BICYCLOÝ3.1.0¨HEX-3-YL)-2-PHENYL-PYRIMIDINES Actelion Pharmaceuticals Ltd. (CH) 2012-02-15 EP disclosed
WO-2010116328-A2 6-(3-AZA-BICYCLO[3.1.0]HEX-3-YL)-2-PHENYL-PYRIMIDINES ACTELION PHARMACEUTICALS LTD (CH) 2010-10-14 WO disclosed