SCHEMBL10631882

SCHEMBL10631882

NC(=O)/C=C\C(=O)OC1(Cc2ccccc2)CCC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 7/20 0.49
▸ CTSL P07711 5/20 0.49
▸ CTSB P07858 4/20 0.49
▸ CTSS P25774 1/20 0.41
▸ HCAR2 Q8TDS4 2/20 0.38
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ LMNA P02545 2/20 0.35
▸ MAP3K7 O43318 1/20 0.33
▸ TAB1 Q15750 1/20 0.33
▸ ADRB2 P07550 1/20 0.33

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
SCHEMBL28951054 0.82 CTSK (0.49) CTSKCTSLCTSBCTSSMAOA
SCHEMBL27823223 0.81 CTSK (0.49) CTSKCTSLCTSBCTSSMAOA
SCHEMBL7531427 0.78 CTSK (0.50) CTSKCTSLCTSBCTSSMAOA
SCHEMBL7648047 0.74 CTSK (0.49) CTSKCTSLCTSBCTSSMAOA
SCHEMBL20959847 0.73 CTSK (0.52) CTSKCTSLCTSBCTSSLMNA
SCHEMBL12831362 0.71 CTSK (0.56) CTSKCTSLCTSBCTSSMAOA
SCHEMBL1881050 0.71 CTSK (0.43) CTSKCTSLCTSBCTSSMAOA
SCHEMBL4580413 0.71 CTSK (0.49) CTSKCTSLCTSBCTSSMAOA
SCHEMBL21061401 0.71 CTSK (0.50) CTSKCTSLCTSBCTSSADRB2
SCHEMBL4580949 0.71 CTSK (0.49) CTSKCTSLCTSBCTSSLMNA

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-4730030-A Arylcyclobutane/dienophile copolymer THE DOW CHEMICAL COMPANY (US) 1988-03-08 — — US disclosed
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