SCHEMBL16867158

SCHEMBL16867158

c1ccc2c(c1)[nH]c1c2c2sc3ccccc3c2c2sc3ccccc3c12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
MAPT P10636 3/20 0.66
RAB9A P51151 1/20 0.66
TNKS O95271 1/20 0.63
TNKS2 Q9H2K2 1/20 0.63
CDK4 P11802 4/20 0.60
CCND1 P24385 4/20 0.60
MAP3K9 P80192 3/20 0.60
MAP3K11 Q16584 3/20 0.60
NTRK1 P04629 1/20 0.53
MAP3K10 Q02779 1/20 0.53
CHEK1 O14757 2/20 0.47
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44

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
SCHEMBL29343607 0.96 MEN1 (0.66) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL15138822 0.90 MEN1 (0.62) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL16867092 0.90 MAP3K9 (0.65) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL15003544 0.90 MEN1 (0.67) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL19961739 0.85 MEN1 (0.56) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL29506382 0.84 MEN1 (0.69) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL22011388 0.84 MAP3K9 (0.67) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL30887363 0.84 MEN1 (0.69) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL15138782 0.84 MEN1 (0.69) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL18687726 0.83 MEN1 (0.63) MEN1KMT2AMAPTRAB9ATNKS

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-117546634-A Electron blocking material, organic semiconductor element, and compound 九州有机光材股份有限公司 2024-02-09 CN disclosed
WO-2015099507-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUND, AND MULTI-COMPONENT HOST MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-07-02 WO disclosed