SCHEMBL20718002

SCHEMBL20718002

C[n+]1c(/C=C/c2ccc(-c3nc4ccccc4s3)o2)sc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.58
▸ MEN1 O00255 8/20 0.58
▸ KMT2A Q03164 8/20 0.58
▸ ALDH1A1 P00352 7/20 0.58
▸ RAB9A P51151 6/20 0.58
▸ KDM4E B2RXH2 6/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ PKM P14618 2/20 0.58
▸ NPC1 O15118 4/20 0.47
▸ NPSR1 Q6W5P4 4/20 0.47
▸ MAPK1 P28482 4/20 0.47
▸ ATM Q13315 1/20 0.45
▸ ADRB2 P07550 2/20 0.44
▸ ADRB1 P08588 1/20 0.44
▸ INSR P06213 1/20 0.43
▸ POLB P06746 6/20 0.39
▸ HPGD P15428 4/20 0.39
▸ PSMD14 O00487 3/20 0.39
▸ PTPN22 Q9Y2R2 3/20 0.39
▸ HTT P42858 3/20 0.39

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
SCHEMBL20718001 0.79 MAPT (0.55) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL20718562 0.76 ADRB2 (0.46) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL20718600 0.76 ADRB2 (0.52) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL20718568 0.76 ADRB2 (0.46) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL10025480 0.74 RAB9A (1.00) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL20718564 0.73 ADRB2 (0.51) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL20718563 0.71 KDM4E (0.52) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL12942446 0.70 KMT2A (0.53) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL16160291 0.67 RAB9A (0.62) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL20718458 0.66 MAPT (0.51) MAPTMEN1KMT2AALDH1A1RAB9A

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-2019025595-A1 SELECTIVE LIGANDS FOR TAU AGGREGATES KARIN & STEN MORTSTEDT CBD SOLUTIONS AB (SE) 2019-02-07 — — WO disclosed
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