SCHEMBL22252872

SCHEMBL22252872

Fc1cc2c(cc1Br)oc1cccc(Cl)c12

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 2/20 0.40
▸ AHR P35869 10/20 0.39
▸ AR P10275 1/20 0.33
▸ PTGES O14684 1/20 0.33
▸ IDO1 P14902 2/20 0.32
▸ PTPN1 P18031 1/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ CSNK2A2 P19784 1/20 0.32
▸ CSNK2B P67870 1/20 0.32
▸ PIM3 Q86V86 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ NMUR2 Q9GZQ4 1/20 0.31
▸ ELANE P08246 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
SCHEMBL30985272 0.76 AHR (0.52) AHRIDO1NMUR2
SCHEMBL28770669 0.76 AHR (0.52) AHRIDO1NMUR2
SCHEMBL19642367 0.75 TTR (0.53) TTRAHRPIM1CSNK2A2CSNK2B
SCHEMBL21638102 0.75 TTR (0.47) TTRAHR
SCHEMBL20926554 0.75 AHR (0.50) TTRAHRPIM1CSNK2A2CSNK2B
SCHEMBL23740424 0.75 AHR (0.50) TTRAHR
SCHEMBL22156332 0.75 TTR (0.47) TTRAHRPIM1CSNK2A2CSNK2B
SCHEMBL29592860 0.75 TTR (0.47) TTRAHRPIM1CSNK2A2CSNK2B
SCHEMBL29414929 0.75 AHR (0.50) TTRAHRPIM1CSNK2A2CSNK2B
SCHEMBL31189111 0.73 AHR (0.53) TTRAHRIDO1

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
WO-2020149610-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-07-23 — — WO disclosed
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