SCHEMBL18912468

SCHEMBL18912468

Brc1ccc2sc3cc(I)ccc3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPM2A O95278 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN22 Q9Y2R2 1/20 0.42
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP2A6 P11509 2/20 0.35
GPR3 P46089 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PIM1 P11309 2/20 0.32
GSK3B P49841 2/20 0.32
CDK5 Q00535 2/20 0.32
CHEK1 O14757 1/20 0.32
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
JAK2 O60674 1/20 0.32
PRKD3 O94806 1/20 0.32

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
SCHEMBL17548894 0.93 EPM2A (0.39) EPM2APTPN2PTPN1PTPN22ALDH1A1
SCHEMBL4921017 0.90 ALDH1A1 (0.34) EPM2APTPN2PTPN1PTPN22ALDH1A1
SCHEMBL15907505 0.90 EPM2A (0.45) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL1993262 0.86 EPM2A (0.47) EPM2APTPN2PTPN1PTPN22ALDH1A1
SCHEMBL22506072 0.86 ALDH1A1 (0.41) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL12811607 0.82 EPM2A (0.50) EPM2APTPN2PTPN1PTPN22ALDH1A1
SCHEMBL31228732 0.82 MAPT (0.41) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL216673 0.82 EPM2A (0.53) EPM2APTPN2PTPN1PTPN22CYP2A6
SCHEMBL4923219 0.82 MAPT (0.41) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL10227300 0.80 EPM2A (0.49) EPM2APTPN2PTPN1PTPN22ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023140529-A1 ORGANIC ELECTRIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-07-27 WO disclosed
EP-3835299-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG Chem, Ltd. (KR) 2021-06-16 EP disclosed
WO-2017217654-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF 덕산네오룩스 주식회사 2017-12-21 WO disclosed
WO-2017090919-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2017-06-01 WO disclosed