SCHEMBL22892596

SCHEMBL22892596

N#Cc1cc(Cl)c2c(c1)oc1c(Br)cccc12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 8/20 0.48
▸ PSMB8 P28062 1/20 0.34
▸ PSMB5 P28074 1/20 0.34
▸ LOXL2 Q9Y4K0 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ 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
▸ DYRK1A Q13627 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ TTR P02766 1/20 0.32
▸ ALB P02768 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TNKS O95271 1/20 0.31
▸ XDH P47989 1/20 0.30
▸ SLC22A12 Q96S37 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
SCHEMBL24225406 0.81 AHR (0.43) AHRPSMB8PSMB5LOXL2PIM1
SCHEMBL19656483 0.78 AHR (0.54) AHRPSMB8LOXL2TTR
SCHEMBL29623029 0.78 IDO1 (0.40) LOXL2IDO1DYRK1ATNKS
SCHEMBL24225403 0.71 AHR (0.54) AHRLOXL2IDO1PIM1CSNK2A2
SCHEMBL19502218 0.70 LOXL2 (0.41) AHRLOXL2MEN1KMT2A
SCHEMBL29805226 0.70 LOXL2 (0.41) AHRLOXL2MEN1KMT2A
SCHEMBL22315719 0.69 IDO1 (0.50) AHRPSMB8PSMB5IDO1PIM1
SCHEMBL31672685 0.69 IDO1 (0.50) AHRPSMB8PSMB5IDO1PIM1
SCHEMBL22195636 0.68 AHR (0.59) AHRPSMB8PSMB5TTR
SCHEMBL29450777 0.68 AHR (0.59) AHRPSMB8PSMB5TTR

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
EP-3764416-B1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2022-01-26 — — EP disclosed
EP-3764416-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF Duk San Neolux Co., Ltd. (KR) 2021-01-13 — — EP disclosed
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