SCHEMBL11637894

SCHEMBL11637894

COC(=O)c1ccc(Sc2ccc3cccc4c3c2C(=O)N4)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.46
▸ KDM4E B2RXH2 5/20 0.46
▸ L3MBTL1 Q9Y468 4/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ LMNA P02545 5/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ HPGD P15428 4/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ ALOX15 P16050 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ RAB9A P51151 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ TP53 P04637 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ IDO1 P14902 1/20 0.35
▸ PIM1 P11309 1/20 0.35

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
SCHEMBL11638611 0.80 MAPT (0.43) MAPTKDM4EMAPK1GAAMEN1
SCHEMBL24317498 0.68 MAPT (0.43) MAPTKDM4EL3MBTL1GAAMEN1
SCHEMBL29532490 0.68 MAPT (0.43) MAPTKDM4EL3MBTL1GAAMEN1
SCHEMBL6575703 0.68 CA1 (0.61) MAPTKDM4EL3MBTL1MAPK1GAA
SCHEMBL17045730 0.66 PARP1 (0.53) MAPTKDM4EMAPK1GAAMEN1
SCHEMBL11318564 0.66 KMT2A (0.45) MAPTL3MBTL1GAAMEN1KMT2A
SCHEMBL24317500 0.66 CDK2 (0.44) MAPTKDM4EL3MBTL1GAAMEN1
SCHEMBL5887658 0.65 TSHR (0.67) MAPTKDM4EL3MBTL1MAPK1MEN1
SCHEMBL7537819 0.64 ALDH1A1 (0.43) KDM4EGAAKMT2AALDH1A1PIM1
SCHEMBL25216142 0.64 ALDH1A1 (0.55) MAPTKDM4EL3MBTL1MAPK1GAA

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-4096145-A DYES FOR RESINS AND POLYESTER TEXTILES BASF AKTIENGESELLSCHAFT (DT) 1978-06-20 — — US disclosed
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