SCHEMBL12700488

SCHEMBL12700488

CN(c1ccccc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.55
TSHR P16473 1/20 0.55
LMNA P02545 2/20 0.50
PGR P06401 5/20 0.49
NR1H2 P55055 1/20 0.48
BAX Q07812 1/20 0.48
MAOA P21397 1/20 0.48
FFAR1 O14842 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 2/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NR3C2 P08235 1/20 0.44

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
SCHEMBL12700566 0.98 LTA4H (0.57) LTA4HTSHRLMNAPGRNR1H2
SCHEMBL12700611 0.90 PGR (0.47) LTA4HTSHRLMNAPGRSMN1; SMN2
SCHEMBL12900151 0.90 HTT (0.50) LTA4HTSHRLMNAPGRFFAR1
SCHEMBL12900155 0.90 HTT (0.50) LTA4HTSHRLMNAPGRFFAR1
SCHEMBL12900153 0.86 HSD17B1 (0.48) LTA4HTSHRPGRFFAR1SMN1; SMN2
SCHEMBL12700494 0.85 MAOB (0.48) LTA4HTSHRPGRSMN1; SMN2ALDH1A1
SCHEMBL10042880 0.85 HTT (0.46) LTA4HTSHRLMNAPGRFFAR1
SCHEMBL7155149 0.83 NR3C2 (0.56) TSHRLMNASMN1; SMN2HPGDHTT
SCHEMBL9479727 0.82 CA4 (0.56) LTA4HPGRHPGD
SCHEMBL5277509 0.82 CA4 (0.56) LTA4HPGRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891121-B1 ORGANIC ELECTROLUMINESCENT ELEMENTS TDK CORP (JP) 2012-09-26 EP disclosed
US-7629094-B2 Electrophotographic photoreceptor, and image forming method, image forming apparatus and process cartridge therefor using the electrophotographic photoreceptor RICOH COMPANY, LTD. (JP) 2009-12-08 US disclosed
US-7629094-B2 Electrophotographic photoreceptor, and image forming method, image forming apparatus and process cartridge therefor using the electrophotographic photoreceptor RICOH COMPANY, LTD. (JP) 2009-12-08 US disclosed