SCHEMBL30809669

SCHEMBL30809669

CC(C)(C)OC(=O)N[C@@H]1CCc2cc(C(=O)O)ccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
SRD5A1 P18405 1/20 0.41
SRD5A2 P31213 1/20 0.41
BDKRB1 P46663 1/20 0.41
RORC P51449 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL21178500 1.00 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL8225460 1.00 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL803438 1.00 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL14902975 0.90 CA12 (0.45) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL784858 0.90 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DTAS1R3
SCHEMBL484634 0.90 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DTAS1R3
SCHEMBL10165183 0.90 CA12 (0.43) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL803935 0.89 CHRNB2 (0.48) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL8253905 0.89 CA12 (0.44) PDE4APDE4BPDE4CPDE4DCA12
SCHEMBL21178383 0.86 CA12 (0.40) PDE4APDE4BPDE4CPDE4DCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573080-A1 INDANE AND COUMARAN DERIVATIVES AS FAST SKELETAL MUSCLE MYOSIN INHIBITORS Cytokinetics, Inc. (US) 2025-06-25 EP disclosed
CN-117964573-A Dihydrobenzofuran and indene analogs as myocardial segment inhibitors 赛特凯恩蒂克公司 2024-05-03 CN disclosed
CN-117924208-A Dihydrobenzofuran and indene analogs as myocardial segment inhibitors 赛特凯恩蒂克公司 2024-04-26 CN disclosed
WO-2024040190-A1 INDANE AND COUMARAN DERIVATIVES AS FAST SKELETAL MUSCLE MYOSIN INHIBITORS CYTOKINETICS, INCORPORATED (US) 2024-02-22 WO disclosed