SCHEMBL442369

SCHEMBL442369

CCCCCCCCOc1ccc(COc2cc(CO)cc(OCc3ccc(OCCCCCCCC)cc3)c2OCc2ccc(OCCCCCCCC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
LTA4H P09960 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
CASP1 P29466 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SLCO1B3 Q9NPD5 1/20 0.46
SLCO1B1 Q9Y6L6 1/20 0.46
TP53 P04637 3/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
GAA P10253 1/20 0.45
PLA2G4B P0C869 4/20 0.44
TSHR P16473 1/20 0.44
HPGD P15428 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
SCHEMBL444675 1.00 NR5A1 (0.53) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413468 0.95 NR5A1 (0.50) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413467 0.95 NR5A1 (0.50) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413514 0.88 NR5A1 (0.54) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413509 0.88 NR5A1 (0.54) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413515 0.88 NR5A1 (0.54) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413512 0.88 NR5A1 (0.54) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413462 0.88 NR5A1 (0.54) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13413510 0.88 NR5A1 (0.54) NR5A1LTA4HMEN1KMT2AUSP2
SCHEMBL13837298 0.86 THRA (0.40) NR5A1

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-8968591-B2 Organic piezoelectric material, ultrasound transducer, ultrasound probe, and ultrasound medical diagnostic imaging system KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2015-03-03 US disclosed
US-20120065516-A1 ORGANIC PIEZOELECTRIC MATERIAL, ULTRASOUND TRANSDUCER, ULTRASOUND PROBE, AND ULTRASOUND MEDICAL DIAGNOSTIC IMAGING SYSTEM KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2012-03-15 US disclosed