SCHEMBL22912459

SCHEMBL22912459

Cc1cccc2oc3ccc(-c4nc5ccccc5s4)cc3c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.51
▸ THRB P10828 2/20 0.51
▸ RAB9A P51151 6/20 0.48
▸ SMN1; SMN2 Q16637 6/20 0.48
▸ NFKB1 P19838 4/20 0.48
▸ NFKB2 Q00653 4/20 0.48
▸ RELA Q04206 4/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ KDM4E B2RXH2 5/20 0.48
▸ TP53 P04637 4/20 0.48
▸ NPC1 O15118 4/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ POLB P06746 2/20 0.48
▸ HPGD P15428 4/20 0.47
▸ PKM P14618 2/20 0.47
▸ APP P05067 5/20 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
SCHEMBL22884597 0.85 MAPT (0.48) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL18289699 0.83 RAB9A (0.57) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL22177375 0.81 MAPT (0.46) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL22912395 0.81 MAPT (0.46) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL22177453 0.81 MAPT (0.46) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL23118196 0.81 MAPT (0.46) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL18289740 0.80 RAB9A (0.56) MAPTRAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL22884238 0.80 MAPT (0.43) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL22177151 0.80 MAPT (0.45) MAPTTHRBRAB9ASMN1; SMN2NFKB1
SCHEMBL22912396 0.80 MAPT (0.45) MAPTTHRBRAB9ASMN1; SMN2NFKB1

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
US-20210020852-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2021-01-21 — — US disclosed
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