SCHEMBL4008584

SCHEMBL4008584

CC(=O)N1CCc2c(Br)cccc2C1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 2/20 0.61
▸ ABHD6 Q9BV23 6/20 0.59
▸ ACACB O00763 3/20 0.48
▸ AKR1C3 P42330 1/20 0.47
▸ CARM1 Q86X55 2/20 0.47
▸ PRMT6 Q96LA8 1/20 0.47
▸ PRMT1 Q99873 1/20 0.47
▸ PTAFR P25105 2/20 0.47
▸ BAZ2B Q9UIF8 3/20 0.45
▸ TRAP1 Q12931 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL12269322 0.88 NOTUM (0.61) NOTUMABHD6CARM1PTAFRBAZ2B
SCHEMBL1550147 0.86 ABHD6 (0.60) NOTUMABHD6ACACBAKR1C3CARM1
SCHEMBL16269157 0.84 ABHD6 (0.55) ABHD6ACACBAKR1C3CARM1PRMT6
SCHEMBL10210758 0.83 NOTUM (0.63) NOTUMABHD6PTAFRBAZ2BTRAP1
SCHEMBL6712189 0.83 NOTUM (0.63) NOTUMABHD6AKR1C3PTAFRBAZ2B
SCHEMBL15935190 0.82 NOTUM (0.58) NOTUMABHD6ACACBPTAFRBAZ2B
SCHEMBL10356953 0.81 NOTUM (0.61) NOTUMABHD6AKR1C3PTAFRBAZ2B
SCHEMBL4512420 0.81 NOTUM (0.61) NOTUMACACBAKR1C3PTAFRTRAP1
SCHEMBL28739037 0.81 ABHD6 (0.55) ABHD6AKR1C3TRAP1LMNA
SCHEMBL22461027 0.81 ABHD6 (0.55) ABHD6AKR1C3MAPT

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-2009007747-A2 HYDANTOIN DERIVATIVES USED AS MMP12 INHIBITORS ASTRAZENECA AB (SE) 2009-01-15 — — WO disclosed
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