SCHEMBL608982

SCHEMBL608982

C=C(C)C(=O)OCc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.49
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
HTR2B P41595 3/20 0.39
HTR7 P34969 2/20 0.39
DRD2 P14416 3/20 0.38
DRD4 P21917 2/20 0.38
DRD3 P35462 2/20 0.38
ALDH1A1 P00352 5/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36

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
SCHEMBL8473291 0.86 PNMT (0.54) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL7000069 0.84 PNMT (0.51) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL4059189 0.83 PNMT (0.54) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL8473288 0.83 PNMT (0.54) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL1830397 0.83 PNMT (0.57) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL9948353 0.83 PNMT (0.50) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL1830400 0.82 PNMT (0.55) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL8671794 0.82 PNMT (0.55) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL19384366 0.82 RAB9A (0.50) PNMTRAB9ANPC1HTR2BHTR7
SCHEMBL4839271 0.81 PNMT (0.51) PNMTRAB9ANPC1HTR2BHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020116254-A1 CELL CULTURE DEVICE 富士フイルム株式会社 2020-06-11 WO disclosed
US-8722812-B2 Method for producing inorganic-organic hybrid particle JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-05-13 US disclosed
EP-2468805-B1 METHOD FOR PRODUCING POLYMER MATERIAL JAPAN SCIENCE & TECH AGENCY (JP) 2013-10-02 EP disclosed
US-8354459-B2 Method for producing polymer material JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2013-01-15 US disclosed
US-20120225970-A1 METHOD FOR PRODUCING POLYMER MATERIAL JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-09-06 US disclosed
EP-2468805-A1 METHOD FOR PRODUCING POLYMER MATERIAL Japan Science and Technology Agency (JP) 2012-06-27 EP disclosed
US-20120041150-A1 INORGANIC - ORGANIC HYBRID PARTICLE AND METHOD FOR PRODUCING THE SAME JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-02-16 US disclosed