SCHEMBL9723736

SCHEMBL9723736

O=C1C=C(C(=O)O)C(c2ccccc2)=CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.39
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
CFTR P13569 1/20 0.36
GOPC Q9HD26 1/20 0.36
PTPN1 P18031 2/20 0.35
PTPRC P08575 1/20 0.35
PTPRF P10586 1/20 0.35
CDC25B P30305 1/20 0.35
HSD17B3 P37058 1/20 0.35
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR4 P22455 1/20 0.33
FGFR3 P22607 1/20 0.33
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33
RXRA P19793 1/20 0.33
NR2E1 Q9Y466 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL9279664 0.82 ALDH1A1 (0.39) KDM4E
SCHEMBL9738923 0.72 LMNA (0.38) BACE1MAOAMAOBPTPN1CDC25B
SCHEMBL3720449 0.72 BACE1 (0.41) BACE1MAOAMAOBCFTRGOPC
SCHEMBL461353 0.71 MAOA (0.31) MAOAMAOB
SCHEMBL9763428 0.69 BACE1 (0.38) BACE1MAOAMAOBCFTRGOPC
SCHEMBL8191410 0.69 BACE1 (0.44) BACE1MAOAMAOBCFTRGOPC
SCHEMBL19814894 0.68 KDM4E (0.34) MAOAMAOBPTPN1KDM4EKMO
SCHEMBL7707431 0.67 MAOA (0.31) MAOAMAOB
SCHEMBL6407297 0.67 CTH (0.31) MAOAMAOB
SCHEMBL11768483 0.66 SRD5A2 (0.47) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114613-A High-speed responsive, stable films; controlling the mesomorphic state and temperature CANON KABUSHIKI KAISHA (JP) 1992-05-19 US disclosed
US-4882085-A Lactic acid derivative and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-11-21 US disclosed