SCHEMBL12900151

SCHEMBL12900151

Cc1ccc(Oc2ccc(Oc3ccc(N(C)c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TEAD4 Q15561 1/20 0.47
NR3C1 P04150 1/20 0.47
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
HTR2A P28223 1/20 0.46
SLC6A4 P31645 1/20 0.46
ALDH1A1 P00352 3/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LTA4H P09960 3/20 0.43
TSHR P16473 2/20 0.43
FFAR1 O14842 1/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 1/20 0.42
PGR P06401 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL12900155 1.00 HTT (0.50) HTTSMN1; SMN2TEAD4NR3C1HSD17B1
SCHEMBL10042880 0.94 HTT (0.46) HTTSMN1; SMN2TEAD4NR3C1HSD17B1
SCHEMBL12900153 0.91 HSD17B1 (0.48) HTTSMN1; SMN2TEAD4NR3C1HSD17B1
SCHEMBL12700488 0.90 LTA4H (0.55) HTTSMN1; SMN2ALDH1A1LTA4HTSHR
SCHEMBL12700566 0.87 LTA4H (0.57) HTTSMN1; SMN2ALDH1A1LTA4HTSHR
Benzene SCHEMBL14537402 0.87 TSHR (0.55) HTTSMN1; SMN2ALDH1A1MAPTTDP1
SCHEMBL3050460 0.87 TSHR (0.55) HTTSMN1; SMN2ALDH1A1MAPTTDP1
SCHEMBL12900152 0.87 HSD17B1 (0.55) SMN1; SMN2HSD17B1HSD17B2ALDH1A1POLB
SCHEMBL23254850 0.86 HTT (0.52) HTTSMN1; SMN2TEAD4NR3C1HSD17B1
SCHEMBL8944029 0.86 HTT (0.52) HTTSMN1; SMN2TEAD4NR3C1HSD17B1

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-9214633-B2 Conjugated polymer, insolubilized polymer, organic electroluminescence element material, composition for organic electroluminescence element, polymer production process, organic electroluminescence element, organic EL display and organic EL lighting MITSUBISHI CHEMICAL CORPORATION (JP) 2015-12-15 US disclosed
US-20140051827-A1 CONJUGATED POLYMER, INSOLUBILIZED POLYMER, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, POLYMER PRODUCTION PROCESS, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2014-02-20 US disclosed
US-8653508-B2 Conjugated polymer, insolubilized polymer, organic electroluminescence element material, composition for organic electroluminescence element, polymer production process, organic electroluminescence element, organic EL display and organic EL lighting MITSUBISHI CHEMICAL CORPORATION (JP) 2014-02-18 US disclosed
US-20110042661-A1 CONJUGATED POLYMER, INSOLUBILIZED POLYMER, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, POLYMER PRODUCTION PROCESS, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-02-24 US disclosed