SCHEMBL27854593

SCHEMBL27854593

Cc1cc2c(c(O)c(C(=O)O)n2C)c(=O)n1CC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.51
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ GPR35 Q9HC97 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.40
▸ F2R P25116 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CXCR3 P49682 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 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
SCHEMBL1062667 0.89 KMT2A (0.51) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL13708880 0.88 LMNA (0.53) LMNANPC1RAB9AGPR35HSD17B10
SCHEMBL1058238 0.86 LMNA (0.49) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL3426735 0.86 SMO (0.49) LMNANPC1RAB9AGPR35MEN1
SCHEMBL1061384 0.84 LMNA (0.47) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL3430411 0.84 SMO (0.42) LMNANPC1RAB9AGPR35MAPT
SCHEMBL10314563 0.84 LMNA (0.49) LMNANPC1RAB9AGPR35HSD17B10
SCHEMBL12962930 0.84 LMNA (0.43) LMNANPC1RAB9AF2RMEN1
SCHEMBL1061569 0.83 LMNA (0.46) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL1060628 0.81 SMO (0.54) LMNANPC1RAB9AHSD17B10MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102015705-B Fused heterocyclic derivative and use thereof TAKEDA PHARMACEUTICAL 2013-11-13 — — CN disclosed
CN-102015705-A Fused heterocyclic derivative and use thereof TAKEDA PHARMACEUTICAL 2011-04-13 — — CN disclosed
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