SCHEMBL18538550

SCHEMBL18538550

COc1c(C)cc(Oc2ccccc2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 4/20 0.56
▸ TSHR P16473 1/20 0.50
▸ CA4 P22748 1/20 0.46
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NLRP3 Q96P20 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ NR1H2 P55055 1/20 0.40
▸ BAX Q07812 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HTT P42858 3/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39

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
Diphenylether SCHEMBL22829709 0.88 LTA4H (0.52) LTA4HTSHRCA4MEN1KMT2A
SCHEMBL25620251 0.87 PTPN1 (0.46) LTA4HSMN1; SMN2ALDH1A1MAPTACHE
SCHEMBL12925863 0.80 LTA4H (0.57) LTA4HTSHRMEN1KMT2ANPC1
SCHEMBL2094797 0.79 LTA4H (0.56) LTA4HTSHRCA4MEN1KMT2A
SCHEMBL12585926 0.79 PTPN1 (0.42) SMN1; SMN2ALDH1A1MAPTKDM4EMAPK1
SCHEMBL18415521 0.78 LTA4H (0.73) LTA4HTSHRCA4MEN1KMT2A
SCHEMBL17737942 0.77 MAPT (0.39) LTA4HTSHRMEN1KMT2ANPC1
SCHEMBL11579139 0.77 LTA4H (0.44) LTA4HTSHRCA4LMNAL3MBTL1
SCHEMBL8517685 0.77 LTA4H (0.52) LTA4HTSHRMEN1KMT2ANPC1
SCHEMBL14036886 0.77 LTA4H (0.52) LTA4HTSHRMEN1KMT2ANPC1

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
US-9828466-B2 Polyphenylene ether derivative having N-substituted maleimide group, and heat curable resin composition, resin varnish, prepreg, metal-clad laminate, and multilayer printed wiring board using same HITACHI CHEMICAL COMPANY, LTD (JP) 2017-11-28 — — US disclosed
US-20170051109-A1 POLYPHENYLENE ETHER DERIVATIVE HAVING N-SUBSTITUTED MALEIMIDE GROUP, AND HEAT CURABLE RESIN COMPOSITION, RESIN VARNISH, PREPREG, METAL-CLAD LAMINATE, AND MULTILAYER PRINTED WIRING BOARD USING SAME HITACHI CHEMICAL COMPANY, LTD. (JP) 2017-02-23 — — US disclosed
CN-100516040-C Nitrogenous heterocyclic derivative having 2,6-disubstituted styryl ASTELLAS PHARMA INC KOTOBUKI S (JP) 2009-07-22 — — CN disclosed
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