SCHEMBL1925578

SCHEMBL1925578

CCCCCc1ccc(C(=O)O)c(-c2ccc(OC(=O)c3ccc(OCCCCCCCCO)cc3)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 3/20 0.54
RARB P10826 6/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 2/20 0.50
LMNA P02545 2/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
MAPT P10636 2/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
PLA2G4B P0C869 1/20 0.47
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46

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
SCHEMBL2433889 1.00 PTPN11 (0.54) PTPN11RARBSMN1; SMN2NPC1LMNA
SCHEMBL11133724 0.88 PTPN11 (0.61) PTPN11RARBSMN1; SMN2LMNACYP3A4
SCHEMBL11138404 0.88 PTPN11 (0.61) PTPN11RARBSMN1; SMN2LMNACYP3A4
SCHEMBL9511120 0.87 PTPN11 (0.63) PTPN11RARBTP53TSHRPLA2G4B
SCHEMBL9511529 0.87 PTPN11 (0.63) PTPN11RARBTP53TSHRPLA2G4B
SCHEMBL1925576 0.85 LMNA (0.63) RARBSMN1; SMN2NPC1LMNANFKB1
SCHEMBL2433887 0.85 LMNA (0.63) RARBSMN1; SMN2NPC1LMNANFKB1
SCHEMBL28564613 0.84 PLK1 (0.50) PTPN11RARBSMN1; SMN2NPC1LMNA
SCHEMBL9485504 0.82 RARB (0.62) PTPN11RARBSMN1; SMN2LMNAMAPT
SCHEMBL7981006 0.82 PTPN11 (0.66) PTPN11RARBMAPTPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2358845-B1 ALIGNMENT FACILITIES FOR OPTICAL DYES TRANSITIONS OPTICAL INC (US) 2014-11-12 EP disclosed
US-8828507-B2 Alignment facilities for optical dyes TRANSITIONS OPTICAL, INC. (US) 2014-09-09 US disclosed
EP-2358845-A1 ALIGNMENT FACILITIES FOR OPTICAL DYES TRANSITIONS OPTICAL, INC. (US) 2011-08-24 EP disclosed
US-8003005-B2 Alignment facilities for optical dyes TRANSITIONS OPTICAL, INC. (US) 2011-08-23 US disclosed
US-20110128457-A1 ALIGNMENT FACILITIES FOR OPTICAL DYES TRANSITIONS OPTICAL, INC. (US) 2011-06-02 US disclosed
WO-2010065406-A1 ALIGNMENT FACILITIES FOR OPTICAL DYES TRANSITIONS OPTICAL, INC. (US) 2010-06-10 WO disclosed
US-20090146104-A1 ALIGNMENT FACILITIES FOR OPTICAL DYES TRANSITIONS OPTICAL, INC. (US) 2009-06-11 US disclosed