SCHEMBL22305368

SCHEMBL22305368

Cc1cccc(-c2csc(NC(=O)CNC(=O)c3ccn(C)c3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.49
▸ CSNK2A2 P19784 1/20 0.47
▸ CSNK2B P67870 1/20 0.47
▸ CSNK2A1 P68400 1/20 0.47
▸ CSNK2A3 Q8NEV1 1/20 0.47
▸ ROCK2 O75116 1/20 0.46
▸ ROCK1 Q13464 1/20 0.46
▸ PHGDH O43175 1/20 0.45
▸ SIRT5 Q9NXA8 1/20 0.44
▸ SMARCA2 P51531 1/20 0.44
▸ SMARCA4 P51532 1/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ POLB P06746 1/20 0.44
▸ ABL1 P00519 2/20 0.43
▸ NAMPT P43490 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ GAA P10253 1/20 0.42

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
SCHEMBL22306588 0.94 SMARCA2 (0.45) MAPTCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL22305714 0.91 WNT3A (0.45) MAPTROCK1PHGDHSMARCA2SMARCA4
SCHEMBL22305480 0.90 MAPT (0.48) MAPTCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL22305951 0.89 MAPT (0.55) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL22290647 0.89 PARP1 (0.47) MAPTROCK2ROCK1SMARCA2SMARCA4
SCHEMBL22306345 0.89 ROCK2 (0.47) MAPTROCK2ROCK1SMARCA2SMARCA4
SCHEMBL31173242 0.89 PARP1 (0.47) MAPTROCK2ROCK1SMARCA2SMARCA4
SCHEMBL22306414 0.88 WNT3A (0.54) ROCK1SMARCA2SMARCA4KMT2AABL1
SCHEMBL22305493 0.88 MAPT (0.47) MAPTCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL22306303 0.88 MAPT (0.47) MAPTCSNK2A2CSNK2BCSNK2A1CSNK2A3

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-2020160180-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2020-08-06 — — WO disclosed
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