SCHEMBL15768397

SCHEMBL15768397

CCCCCCCCOc1ccc(C(=O)O)nc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.62
TP53 P04637 1/20 0.62
PLA2G4B P0C869 6/20 0.60
RARB P10826 3/20 0.57
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPT P10636 1/20 0.56
PKM P14618 1/20 0.56
ALOX15 P16050 1/20 0.56
NFKB1 P19838 1/20 0.56
THPO P40225 1/20 0.56
BLM P54132 1/20 0.56
PMP22 Q01453 1/20 0.56
KMT2A Q03164 1/20 0.56
HIF1A Q16665 1/20 0.56
TDP1 Q9NUW8 1/20 0.56

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
SCHEMBL10662140 1.00 TSHR (0.62) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL10663731 1.00 TSHR (0.62) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL10664855 0.98 TSHR (0.59) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL1749748 0.95 KDM4E (0.61) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL11474833 0.94 KDM4E (0.59) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL2274826 0.94 KDM4E (0.59) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL3630216 0.89 P4HTM (0.59) TSHRTP53PLA2G4BKDM4EMEN1
SCHEMBL9733601 0.88 RARB (0.68) TSHRTP53PLA2G4BRARBKDM4E
SCHEMBL2274462 0.87 P4HTM (0.58) TSHRTP53PLA2G4BKDM4EMEN1
Fusaric Acid SCHEMBL11478350 0.85 NFKB1 (0.81) TSHRTP53PLA2G4BKDM4EMEN1

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
EP-2894148-B1 NOVEL SMECTIC PHASE A LIQUID CRYSTAL MATERIAL HALATION PHOTONICS CORP (CN) 2019-04-03 EP disclosed
CN-103666482-B A kind of smectic A phase liquid crystal material HALATION PHOTONICS CO., LTD. (CN) 2016-05-25 CN disclosed
EP-2894148-A1 NOVEL SMECTIC PHASE A LIQUID CRYSTAL MATERIAL Halation Photonics Corporation (CN) 2015-07-15 EP disclosed
US-20140160384-A1 SMECTIC A-PHASE LIQUID CRYSTAL MATERIAL HALATION PHOTONICS CORPORATION (CN) 2014-06-12 US disclosed