SCHEMBL8045370

SCHEMBL8045370

CC(C)=CCOC(=O)COc1ccc(OCC(=O)OCC=C(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
TRPV1 Q8NER1 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
BLM P54132 2/20 0.44
PMP22 Q01453 1/20 0.44
PTGS2 P35354 1/20 0.43
LMNA P02545 2/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
MAPT P10636 1/20 0.42
CNR1 P21554 1/20 0.42

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
SCHEMBL8035873 0.91 TRPV1 (0.46) GAANPSR1TRPV1SMN1; SMN2CYP1A2
SCHEMBL8045382 0.91 GAA (0.43) GAANPSR1TRPV1SMN1; SMN2CYP1A2
SCHEMBL8035505 0.91 GAA (0.42) GAANPSR1TRPV1SMN1; SMN2CYP1A2
SCHEMBL8035861 0.91 TRPV1 (0.46) GAANPSR1TRPV1SMN1; SMN2CYP1A2
SCHEMBL8053320 0.89 GAA (0.44) GAANPSR1TRPV1SMN1; SMN2CYP1A2
SCHEMBL8046472 0.89 TRPV1 (0.45) GAANPSR1TRPV1SMN1; SMN2CYP1A2
SCHEMBL9856587 0.80 MAPT (0.49) GAABLMLMNAHPGDMEN1
SCHEMBL8036010 0.76 KDM4E (0.53) GAABLMLMNAHPGDMEN1
SCHEMBL24871065 0.75 HPGD (0.57) GAANPSR1SMN1; SMN2LMNAHPGD
SCHEMBL9542594 0.74 ALDH1A1 (0.53) GAANPSR1SMN1; SMN2CYP1A2CYP3A4

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-0679649-B1 2,3-Dihydrobenzofuran Derivatives ASAHI CHEMICAL IND (JP) 2000-04-26 EP disclosed
US-6010826-A Resist composition NIPPON ZEON CO., LTD. (JP) 2000-01-04 US disclosed
EP-0786701-A1 RESIST COMPOSITION NIPPON ZEON CO., LTD. (JP) 1997-07-30 EP disclosed
EP-0679649-A1 2,3-DIHYDROBENZOFURAN DERIVATIVE Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-11-02 EP disclosed