SCHEMBL13068574

SCHEMBL13068574

CCCCCC[C@@H](C)Oc1ccc(-c2ccc(-c3ccc(OC)cc3)c(F)c2F)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.37
CYP2C19 P33261 1/20 0.37
MMP9 P14780 4/20 0.37
MMP13 P45452 4/20 0.37
ADAM17 P78536 4/20 0.37
MMP1 P03956 4/20 0.37
GPR88 Q9GZN0 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
PTGES O14684 2/20 0.36
MAPT P10636 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MGLL Q99685 5/20 0.34
DHODH Q02127 1/20 0.34

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
SCHEMBL12324663 0.90 DHODH (0.36) APPCYP2C19MMP9MMP13ADAM17
SCHEMBL12324326 0.90 CNR1 (0.34) GPR88MAPTMGLL
SCHEMBL10000688 0.90 GPR88 (0.36) GPR88MAPT
SCHEMBL10000689 0.88 NR5A1 (0.43) GPR88MAPT
SCHEMBL13029242 0.88 NR5A1 (0.43)
SCHEMBL14392105 0.86 GPR88 (0.36) GPR88MGLL
SCHEMBL12286851 0.84 RARB (0.37) GPR88
SCHEMBL13029244 0.84 RARB (0.37) GPR88
SCHEMBL17084300 0.82 MAPT (0.35) MAPT
SCHEMBL10000690 0.82 CTRC (0.49) GPR88

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-8368831-B2 Oligosiloxane modified liquid crystal formulations and devices using same DOW CORNING CORPORATION (US) 2013-02-05 US disclosed
US-20100283927-A1 OLIGOSILOXANE MODIFIED LIQUID CRYSTAL FORMULATIONS AND DEVICES USING SAME DOW CORNING CORPORATION (US) 2010-11-11 US disclosed