SCHEMBL4946606

SCHEMBL4946606

O=C(O)c1ccc(OCCCCCCO)cc1F

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.53
RARB P10826 1/20 0.53
PTPN11 Q06124 3/20 0.47
PRKAB2 O43741 2/20 0.46
PRKAG1 P54619 2/20 0.46
PRKAA2 P54646 2/20 0.46
PRKAA1 Q13131 2/20 0.46
PRKAG3 Q9UGI9 2/20 0.46
PRKAG2 Q9UGJ0 2/20 0.46
PRKAB1 Q9Y478 2/20 0.46
MAOB P27338 1/20 0.46
MCL1 Q07820 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45

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
SCHEMBL7814595 0.87 RARB (0.66) RARARARBPTPN11MCL1
SCHEMBL1583118 0.87 RARB (0.66) RARARARBPTPN11MCL1
SCHEMBL7821266 0.87 RARB (0.66) RARARARBPTPN11MCL1
SCHEMBL7824715 0.87 RARB (0.66) RARARARBPTPN11MCL1
SCHEMBL9626748 0.87 RARB (0.66) RARARARBPTPN11MCL1
SCHEMBL5645573 0.86 RARA (0.54) RARARARBPTPN11MAOBMCL1
Hydrochloric Acid SCHEMBL9626908 0.85 RARB (0.64) RARARARBPTPN11MCL1
Hydrochloric Acid SCHEMBL9650215 0.85 RARB (0.64) RARARARBPTPN11MCL1
SCHEMBL7825340 0.84 RARB (0.71) RARARARBPTPN11MAOBMCL1
SCHEMBL3083648 0.84 RARA (0.56) RARARARBPRKAB2PRKAG1PRKAA2

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-7378135-B2 Polymerizable liquid crystal composition and optically anisotropic thin film CHISSO CORPORATION (JP) 2008-05-27 US disclosed
US-20060222784-A1 Polymerizable liquid crystal composition and optically anisotropic thin film JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2006-10-05 US disclosed