SCHEMBL2632213

SCHEMBL2632213

O=Cc1ccc(Oc2cccc(-c3ccc(N(c4ccc(-c5cccc(Oc6ccc(C=O)cc6)c5)cc4)c4ccc(-c5cccc(Oc6ccc(C=O)cc6)c5)cc4)cc3)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.55
FFAR4 Q5NUL3 4/20 0.43
FFAR1 O14842 2/20 0.43
ALDH1A1 P00352 4/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PARP10 Q53GL7 1/20 0.40
PARP3 Q9Y6F1 1/20 0.40
GSTP1 P09211 1/20 0.39
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
ELANE P08246 1/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38
ALDH3A1 P30838 1/20 0.38
ALDH1A3 P47895 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL2623451 0.93 DRD1 (0.49) DRD1FFAR4FFAR1ALDH1A1LMNA
SCHEMBL2623457 0.90 DRD1 (0.45) DRD1FFAR4FFAR1ALDH1A1MAPT
SCHEMBL2623395 0.85 FFAR4 (0.40) DRD1FFAR4FFAR1ALDH1A1MAPT
SCHEMBL3804053 0.84 ALDH1A1 (0.58) DRD1FFAR4FFAR1ALDH1A1KDM4E
SCHEMBL10062321 0.82 PARP10 (0.53) DRD1ALDH1A1MAPTKDM4ELMNA
SCHEMBL18903910 0.80 FFAR4 (0.46) DRD1FFAR4FFAR1ALDH1A1MAPT
SCHEMBL8546955 0.79 ALDH1A1 (0.55) DRD1ALDH1A1MAPTKDM4ELMNA
SCHEMBL2623456 0.78 ACACB (0.45) FFAR4FFAR1ALDH1A1MAPTLMNA
SCHEMBL16385729 0.78 GSTP1 (0.46) FFAR4FFAR1ALDH1A1MAPTKDM4E
SCHEMBL4757476 0.78 DRD1 (0.50) DRD1TRIM24TRIM33ELANECA12

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-20150079714-A1 COMPOSITION FOR USE IN ORGANIC DEVICE, POLYMER FILM, AND ORGANIC ELECTROLUMINESCENT ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2015-03-19 US disclosed
US-20120091443-A1 COMPOSITION FOR USE IN ORGANIC DEVICE, POLYMER FILM, AND ORGANIC ELECTROLUMINESCENT ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2012-04-19 US disclosed
US-20100045174-A1 COMPOSITION FOR USE IN ORGANIC DEVICE, POLYMER FILM, AND ORGANIC ELECTROLUMINESCENT ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-25 US disclosed
US-20100045174-A1 COMPOSITION FOR USE IN ORGANIC DEVICE, POLYMER FILM, AND ORGANIC ELECTROLUMINESCENT ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-25 US disclosed