SCHEMBL5355707

SCHEMBL5355707

CCCCCCCCOc1ccc(C2C=CC(C(=O)O)(c3ccccc3OCCCCCCCC)C=C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
PLA2G4B P0C869 1/20 0.43
FAAH O00519 11/20 0.42
RARB P10826 3/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42
MAPT P10636 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL8376749 1.00 TP53 (0.44) TP53TSHRPLA2G4BFAAHRARB
SCHEMBL8533885 0.91 FFAR1 (0.41) TP53TSHRPLA2G4BFAAHMEN1
SCHEMBL9821354 0.85 FAAH (0.38) TP53TSHRPLA2G4BFAAH
SCHEMBL6233132 0.83 PLA2G4B (0.39) TP53TSHRPLA2G4BFAAHRARB
SCHEMBL9157438 0.81 ALDH1A1 (0.48) TP53TSHRPLA2G4BFAAHLMNA
SCHEMBL9615779 0.81 ALDH1A1 (0.51) TP53TSHRPLA2G4BFAAHRARB
SCHEMBL7778259 0.81 ALDH1A1 (0.51) TP53TSHRPLA2G4BFAAHRARB
SCHEMBL9155601 0.81 ALDH1A1 (0.46) TP53TSHRPLA2G4BFAAHRARB
SCHEMBL7773614 0.81 ALDH1A1 (0.51) TP53TSHRPLA2G4BFAAHRARB
SCHEMBL7780455 0.81 ALDH1A1 (0.51) TP53TSHRPLA2G4BFAAHRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7211201-B2 Antiferroelectric liquid crystal and its manufacturing method JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-05-01 US claimed
US-20050156142-A1 Antiferroelectric liquid crystal and its manufacturing method JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2005-07-21 US claimed
US-7211201-B2 Antiferroelectric liquid crystal and its manufacturing method JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-05-01 US disclosed
EP-1514916-A1 ANTIFERROELECTRIC LIQUID CRYSTAL AND ITS MANUFACTURING METHOD Japan Science and Technology Agency (JP) 2005-03-16 EP disclosed