SCHEMBL14129693

SCHEMBL14129693

CS(=O)(=O)OCCOCCOCCN(CCOCCOCCOS(C)(=O)=O)c1ccc(I)cc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MMP9 P14780 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTR2A P28223 1/20 0.31
▸ HTR2C P28335 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL14421026 0.84 TSHR (0.36) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL18992740 0.78 ALDH1A1 (0.38) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL14129675 0.76 APP (0.34) —
SCHEMBL14129566 0.76 MEN1 (0.39) KDM4EALDH1A1TSHR
SCHEMBL8872313 0.74 RORC (0.34) KDM4EALDH1A1LMNATSHRHTR2A
SCHEMBL12782495 0.74 CNR2 (0.42) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL6972956 0.74 CNR2 (0.40) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL13406739 0.72 PPARG (0.31) —
SCHEMBL29360890 0.72 ALDH1A1 (0.43) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL1298937 0.72 ALDH1A1 (0.53) KDM4EUSP2ALDH1A1LMNAMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7393598-B2 Light emitting molecules and organic light emitting devices including light emitting molecules HCF PARTNERS, L.P. (US) 2008-07-01 — — US disclosed
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