SCHEMBL13250573

SCHEMBL13250573

c1ccc(N(c2ccccc2)c2cnc(N(c3ccccc3)c3ccc4ccccc4c3)c3ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ KEAP1 Q14145 3/20 0.31
▸ NFE2L2 Q16236 3/20 0.31
▸ TRPM8 Q7Z2W7 1/20 0.30
▸ SYK P43405 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL13250568 0.86 KEAP1 (0.36) KDM4EKEAP1NFE2L2ALDH1A1L3MBTL1
SCHEMBL1753896 0.81 KDM4E (0.37) KDM4EALDH1A1LMNATSHRHTT
SCHEMBL5473751 0.80 SIGMAR1 (0.37) KDM4EALDH1A1LMNATSHRHTT
SCHEMBL2544706 0.79 KDM4E (0.35) KDM4EALDH1A1LMNATSHRHTT
SCHEMBL8051257 0.77 KDM4E (0.35) KDM4EALDH1A1LMNATSHRHTT
SCHEMBL9889005 0.77 ALDH1A1 (0.39) KDM4EALDH1A1LMNATSHRHTT
SCHEMBL26851752 0.77 HPRT1 (0.38) KDM4EALDH1A1LMNAHTTNPSR1
SCHEMBL700417 0.76 ALDH1A1 (0.40) KDM4EALDH1A1LMNAHTTNPSR1
SCHEMBL29422203 0.76 ALDH1A1 (0.40) KDM4EALDH1A1LMNAHTTNPSR1
SCHEMBL13408757 0.76 ALDH1A1 (0.34) KDM4EALDH1A1LMNATSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100176377-A1 Polymeric compound and polymeric electroluminescence element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-15 — — US disclosed
US-20100176377-A1 Polymeric compound and polymeric electroluminescence element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-15 — — US disclosed
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