SCHEMBL23463118

SCHEMBL23463118

COC(=O)c1cccc(Br)c1-c1ccccc1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.55
▸ TSHR P16473 2/20 0.55
▸ HTT P42858 2/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ MAPK10 P53779 1/20 0.55
▸ PTK2B Q14289 1/20 0.55
▸ NCOA1 Q15788 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ NCOA3 Q9Y6Q9 1/20 0.55
▸ SLC6A3 Q01959 5/20 0.54
▸ PDK2 Q15119 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ SLC6A4 P31645 3/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ CFTR P13569 1/20 0.47
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46

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
SCHEMBL15525214 0.84 SLC6A3 (0.63) KMT2ATSHRHTTMEN1MAPT
SCHEMBL28289664 0.83 FABP4 (0.55) KMT2ATSHRHTTMEN1MAPT
SCHEMBL70816 0.80 TSHR (0.62) KMT2ATSHRHTTMEN1MAPT
SCHEMBL70284 0.80 MAPT (0.67) KMT2ATSHRHTTMEN1MAPT
SCHEMBL29433258 0.80 TSHR (0.61) KMT2ATSHRHTTMEN1MAPT
SCHEMBL23659 0.80 TSHR (0.61) KMT2ATSHRHTTMEN1MAPT
SCHEMBL6536484 0.79 ALDH1A1 (0.55) KMT2AMEN1MAPTSMN1; SMN2LMNA
SCHEMBL25523280 0.79 SLC6A3 (0.56) KMT2ATSHRHTTMEN1MAPT
SCHEMBL16547421 0.78 TDP1 (0.50) KMT2ATSHRHTTMEN1MAPT
SCHEMBL12424592 0.77 TSHR (0.46) KMT2ATSHRHTTMEN1MAPT

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-2021103728-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 浙江华显光电科技有限公司 2021-06-03 — — WO disclosed
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