SCHEMBL22163743

SCHEMBL22163743

C=C1C=CC(=O)N1c1ccc(N2C(=C)C=CC2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 16/20 0.67
▸ FAAH O00519 6/20 0.67
▸ HSP90AA1 P07900 3/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ PKM P14618 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ DDAH1 O94760 1/20 0.48
▸ BCHE P06276 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CCR6 P51684 1/20 0.47
▸ CACNA1B Q00975 1/20 0.47
▸ APBA1 Q02410 1/20 0.47
▸ APOBEC3G Q9HC16 1/20 0.47

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
SCHEMBL15945078 0.98 MGLL (0.71) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL21801270 0.89 MGLL (0.73) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL19075848 0.89 MGLL (0.73) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL23824822 0.89 MGLL (0.73) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL12924967 0.89 MGLL (0.71) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL17485078 0.86 MGLL (0.78) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL14550102 0.86 MGLL (0.50) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL19075843 0.84 MGLL (0.53) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL15082451 0.84 DDAH1 (0.76) MGLLFAAHHSP90AA1TDP1PKM
SCHEMBL15082418 0.83 MGLL (0.47) MGLLFAAHHSP90AA1TDP1PKM

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
EP-3670132-A1 TIRE PRODUCTION METHOD, AND TIRE Bridgestone Corporation (JP) 2020-06-24 — — EP disclosed
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