SCHEMBL19889016

SCHEMBL19889016

C=CC(=O)Nc1cccc(C(=O)c2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 3/20 0.66
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ GAA P10253 1/20 0.57
▸ RAB9A P51151 2/20 0.54
▸ BLM P54132 1/20 0.54
▸ ATM Q13315 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ PDK1 Q15118 1/20 0.52
▸ PDK2 Q15119 1/20 0.52
▸ PDK3 Q15120 1/20 0.52
▸ PDK4 Q16654 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.51
▸ CREBBP Q92793 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ MAPT P10636 3/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50

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
SCHEMBL1668968 0.87 TGM2 (0.65) TGM2RAB9ACREBBPLMNAMEN1
SCHEMBL39036 0.85 TGM2 (0.72) TGM2L3MBTL1RAB9ANPSR1ALDH1A1
SCHEMBL1925142 0.83 KMT2A (0.71) TGM2RAB9ATDP1NPSR1CREBBP
SCHEMBL4103284 0.82 TGM2 (0.76) TGM2LMNAEGFR
SCHEMBL8686781 0.82 PARP1 (0.68) TGM2MEN1KMT2A
SCHEMBL12096453 0.81 L3MBTL1 (0.68) L3MBTL1GAARAB9ABLMATM
SCHEMBL81209 0.80 TGM2 (1.00) TGM2NPSR1LMNAEGFR
SCHEMBL19501282 0.80 TGM2 (0.76) TGM2RAB9AMAPTLMNAMEN1
SCHEMBL7745302 0.80 KCNK3 (0.79) L3MBTL1GAARAB9ABLMTDP1
SCHEMBL28847032 0.79 KMT2A (0.58) TGM2GAAALDH1A1MAPTLMNA

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
US-20190293641-A1 ASSAY IMPERIAL COLLEGE INNOVATIONS, LTD. (GB) 2019-09-26 — — US disclosed
WO-2018033753-A2 ASSAY IMPERIAL INNOVATIONS LIMITED (GB) 2018-02-22 — — WO disclosed
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