SCHEMBL11255146

SCHEMBL11255146

CCCCCCCCCCC(O)CN1CCN=C(C)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
FFAR4 Q5NUL3 1/20 0.37
FFAR1 O14842 1/20 0.37
NFKB1 P19838 1/20 0.36
PTGER4 P35408 3/20 0.35
PTGER3 P43115 3/20 0.35
PTGER2 P43116 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ADA P00813 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL11261966 0.93 GPR84 (0.37) GPR84ALDH1A1GAAMAPTTHRB
SCHEMBL11473310 0.84 ADA (0.38) GPR84ALDH1A1FFAR4FFAR1L3MBTL1
SCHEMBL11270392 0.83 ALDH1A1 (0.35) GPR84ALDH1A1GAAMAPTTHRB
SCHEMBL11264220 0.79 ALDH1A1 (0.51) ALDH1A1GAAMAPTTHRB
SCHEMBL11252637 0.79 ALDH1A1 (0.51) ALDH1A1GAAMAPTTHRB
SCHEMBL11270382 0.79 GPR84 (0.34) GPR84ALDH1A1GAAMAPTTHRB
SCHEMBL9161023 0.76 ADA (0.36) GPR84ALDH1A1FFAR4FFAR1L3MBTL1
SCHEMBL9163324 0.76 ADA (0.36) GPR84ALDH1A1FFAR4FFAR1L3MBTL1
SCHEMBL9166170 0.76 ADA (0.36) GPR84ALDH1A1FFAR4FFAR1L3MBTL1
SCHEMBL11481562 0.76 ADA (0.36) GPR84ALDH1A1FFAR4FFAR1L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56140977-A None JP disclosed
US-4346087-A CORROSION RESISTANCE TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-24 US disclosed
JP-S56140977-A N- 2-HYDROXY ALKYLAZAALKENELACTAM TOHO CHEM IND CO LTD 1981-11-04 JP disclosed