SCHEMBL27987992

SCHEMBL27987992

CCCCOc1ccc(I)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.50
▸ THRB P10828 3/20 0.45
▸ THRA P10827 2/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ LTA4H P09960 3/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ NR5A1 Q13285 1/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA3 P07451 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA6 P23280 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 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
SCHEMBL256301 0.93 KDM4E (0.46) KDM4ETHRBTHRAKMT2ASMN1; SMN2
SCHEMBL17614043 0.85 KDM4E (0.50) KDM4ETHRBTHRAKMT2ANPC1
SCHEMBL12885024 0.82 KDM4E (0.69) KDM4ETHRBTHRAKMT2ANPC1
SCHEMBL27929661 0.79 CYP3A4 (0.45) THRBTHRAKMT2ANPC1RAB9A
SCHEMBL3785500 0.79 SMN1; SMN2 (0.59) KDM4ETHRBTHRAKMT2ANPC1
SCHEMBL3788905 0.78 KDM4E (0.50) KDM4ETHRBTHRAKMT2ANPC1
SCHEMBL17912821 0.78 LTA4H (0.50) KDM4ETHRBTHRAKMT2ANPC1
SCHEMBL20503253 0.78 KDM4E (0.63) KDM4ETHRBTHRAKMT2ASMN1; SMN2
SCHEMBL12666816 0.78 LTA4H (0.55) THRBTHRAKMT2ANPC1RAB9A
SCHEMBL2151879 0.76 NR5A1 (0.53) THRBTHRAKMT2ANPC1RAB9A

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
CN-104230682-B A kind of method preparing alkoxyl iodobenzene 河南科技大学 2016-09-07 — — CN disclosed
CN-104230682-A Method for preparing alkoxy iodobenzene UNIV HENAN SCIENCE & TECH 2014-12-24 — — CN disclosed
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