SCHEMBL21241834

SCHEMBL21241834

CNSc1cccc(C(=O)NCC(=O)Nc2nc(-c3ccccc3)cs2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.51
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ ELOVL1 Q9BW60 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ NPC1 O15118 1/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SCD O00767 1/20 0.49
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC2 Q92769 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ SLC12A2 P55011 1/20 0.48
▸ SLC12A5 Q9H2X9 1/20 0.48

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
SCHEMBL21241945 0.90 MAPT (0.53) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21241835 0.88 ELOVL1 (0.52) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21241931 0.88 MAPT (0.55) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21241901 0.85 MAPT (0.48) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21224313 0.82 MAPT (0.53) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21242057 0.82 MAPT (0.58) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21241854 0.82 MAPT (0.48) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21224641 0.82 MAPT (0.56) MAPTMEN1KMT2AALDH1A1MAPK1
SCHEMBL21224424 0.82 MAPT (0.52) MAPTMEN1KMT2AELOVL1ALDH1A1
SCHEMBL21225263 0.82 KDM4A (0.62) MAPTMEN1KMT2AELOVL1ALDH1A1

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-2019152437-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2019-08-08 — — WO disclosed
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