SCHEMBL5077782

SCHEMBL5077782

O=C(O)CCC1NC(=O)C(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 4/20 0.40
ABL1 P00519 2/20 0.39
IDE P14735 2/20 0.39
RIN1 Q13671 2/20 0.39
PPARG P37231 1/20 0.39
NR2E3 Q9Y5X4 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
LMNA P02545 4/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
SUCNR1 Q9BXA5 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
FOLH1 Q04609 1/20 0.37
EGFR P00533 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGB2 P05107 1/20 0.37
ITGB1 P05556 1/20 0.37
ITGAV P06756 1/20 0.37
ITGA2B P08514 1/20 0.37

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
SCHEMBL9257771 0.75 NPSR1 (0.47) NPSR1TDP1ABL1IDERIN1
SCHEMBL1679984 0.73 NPSR1 (0.50) NPSR1TDP1ABL1IDERIN1
SCHEMBL31707085 0.73 NPSR1 (0.50) NPSR1TDP1ABL1IDERIN1
SCHEMBL9599046 0.73 TDP1 (0.40) NPSR1TDP1ABL1IDERIN1
SCHEMBL9637149 0.72 NPSR1 (0.38) NPSR1TDP1ABL1IDERIN1
SCHEMBL3759950 0.70 LMNA (0.38) NPSR1LMNAALKBH5SUCNR1EGLN1
SCHEMBL17930204 0.70 HSD17B10 (0.42) NPSR1TDP1ABL1IDERIN1
SCHEMBL7264417 0.70 ITGB1 (0.63) NPSR1TDP1ABL1IDERIN1
SCHEMBL16328752 0.68 EGFR (0.40) NPSR1TDP1ABL1IDERIN1
SCHEMBL31124633 0.66 ITGB1 (0.42) NPSR1TDP1ABL1IDERIN1

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-20080317689-A1 Transdermal Preparation for External Use Containing Antiinflammatory/Analgesic Agent HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2008-12-25 US disclosed
US-6387359-B1 N-LONG CHAIN ACYLAMINO ACID POLYGLYCERIN ESTERS; COSMETICS AJINOMOTO CO., INC. (JP) 2002-05-14 US disclosed