SCHEMBL11032273

SCHEMBL11032273

NCCCc1ccc(CCC(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.61
KEAP1 Q14145 1/20 0.59
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
MAPK1 P28482 1/20 0.55
ADRA1A P35348 1/20 0.55
SLC6A3 Q01959 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MAPT P10636 1/20 0.52

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
SCHEMBL11269425 0.92 MAPT (0.58) FFAR1KEAP1CA1CA2HDAC3
SCHEMBL11134916 0.92 MAPT (0.58) FFAR1KEAP1CA1CA2HDAC3
SCHEMBL25941287 0.89 FFAR1 (0.65) FFAR1KEAP1CA1CA2HDAC3
SCHEMBL4845038 0.87 FFAR1 (0.65) FFAR1KEAP1CA1CA2SMN1; SMN2
SCHEMBL11424035 0.87 FFAR1 (0.71) FFAR1KEAP1CA1CA2HDAC3
Hydrochloric Acid SCHEMBL11105604 0.85 FFAR1 (0.63) FFAR1KEAP1CA1CA2SMN1; SMN2
SCHEMBL7827706 0.85 MAPT (0.69) FFAR1KEAP1CA1CA2HDAC3
SCHEMBL69746 0.84 FFAR1 (0.81) FFAR1KEAP1CA1CA2HDAC3
Glutarate SCHEMBL4744748 0.84 HDAC3 (0.74) FFAR1KEAP1HDAC3HDAC4HDAC1
SCHEMBL11135780 0.84 MAPT (0.63) FFAR1HDAC3HDAC4HDAC1HDAC7

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-4536391-A REACTING A PLASMIN HEAVY CHAIN WITH UROKINASE IN THE PRESENCE OF A COUPLING AGENT OTSUKA PHARMACEUTICAL CO. (JP) 1985-08-20 US disclosed
EP-0109653-A2 Process for preparing urokinase complex OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-05-30 EP disclosed