SCHEMBL9817828

SCHEMBL9817828

C=CCN(CCO)CCCCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC4 O15439 1/20 0.46
MAPT P10636 1/20 0.46
GPR84 Q9NQS5 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
CAMK2A Q9UQM7 1/20 0.40
LMNA P02545 2/20 0.39
TSHR P16473 2/20 0.38
NFKB1 P19838 1/20 0.38
PMP22 Q01453 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM5A P29375 4/20 0.36
KDM4E B2RXH2 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.34
KDM4C Q9H3R0 2/20 0.34
PHF8 Q9UPP1 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL8090929 0.83 ABCC4 (0.48) ABCC4MAPTGPR84CAMK2ALMNA
Hydrochloric Acid SCHEMBL9867602 0.81 ABCC4 (0.47) ABCC4MAPTCAMK2ALMNATSHR
SCHEMBL34468879 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL7945168 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL11049932 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL19616399 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL18641695 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL9409755 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL10985408 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA
SCHEMBL1408426 0.81 GPR84 (0.58) GPR84FFAR1FFAR4CAMK2ALMNA

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
EP-0445159-A1 SURFACE ACTIVE MIXTURES Henkel Kommanditgesellschaft auf Aktien (DE) 1991-09-11 EP disclosed
WO-1990006105-A2 SURFACE ACTIVE MIXTURES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1990-06-14 WO disclosed
EP-0371339-A2 Surfactant mixtures Henkel Kommanditgesellschaft auf Aktien (DE) 1990-06-06 EP disclosed