SCHEMBL3192071

SCHEMBL3192071

CCCCCCCCc1ccc(C(=O)O)c(-c2ccc(-c3ccc(C#N)cc3)cc2)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.63
HSD17B10 Q99714 1/20 0.63
RARB P10826 10/20 0.57
RARA P10276 2/20 0.57
RARG P13631 1/20 0.57
PPARA Q07869 2/20 0.55
KAT8 Q9H7Z6 2/20 0.52
PPARG P37231 1/20 0.52
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MAPT P10636 1/20 0.51
MTOR P42345 1/20 0.51
KMT2A Q03164 1/20 0.51
LTB4R2 Q9NPC1 1/20 0.51
PLK1 P53350 1/20 0.44

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
SCHEMBL6269842 0.99 TSHR (0.60) TSHRHSD17B10RARBRARARARG
SCHEMBL6267448 0.98 TSHR (0.58) TSHRHSD17B10RARBRARARARG
SCHEMBL9755573 0.94 TSHR (0.65) TSHRHSD17B10RARBRARARARG
SCHEMBL11768545 0.94 LTB4R2 (0.53) TSHRHSD17B10RARBRARARARG
SCHEMBL7512343 0.89 LTB4R2 (0.53) TSHRHSD17B10RARBRARARARG
Benzoic Acid SCHEMBL11341174 0.87 LTB4R2 (0.53) TSHRHSD17B10RARBRARAPPARA
SCHEMBL9247776 0.87 RARB (0.68) RARBRARARARGPPARAKAT8
SCHEMBL11135668 0.87 RARB (0.68) RARBRARARARGPPARAKAT8
SCHEMBL9155410 0.87 RARB (0.68) RARBRARARARGPPARAKAT8
SCHEMBL9148526 0.87 TSHR (0.45) TSHRHSD17B10RARBRARARARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678292-B2 Liquid crystal dopants POLYDISPLAY ASA (NO) 2010-03-16 US disclosed
EP-1537190-B1 LIQUID CRYSTAL DOPANTS POLYDISPLAY ASA (NO) 2007-11-07 EP disclosed
US-20060091358-A1 Liquid crystal dopants POLYDISPLAY ASA (NO) 2006-05-04 US disclosed
EP-1537190-A1 LIQUID CRYSTAL DOPANTS PolyDisplay ASA (NO) 2005-06-08 EP disclosed
WO-2004022670-A1 LIQUID CRYSTAL DOPANTS POLYDISPLAY ASA (NO) 2004-03-18 WO disclosed