SCHEMBL9407019

SCHEMBL9407019

C=CCC(O)(C=C)OC(=O)CCC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.33
ABCC4 O15439 1/20 0.33
MAPT P10636 1/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
LMNA P02545 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.32
SUCNR1 Q9BXA5 1/20 0.32

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
SCHEMBL9407015 0.93
SCHEMBL27230120 0.76 EGLN1 (0.38) EGLN1ABCC4MAPTKDM6BKDM5C
SCHEMBL7837509 0.74 EGLN1 (0.36) EGLN1ABCC4MAPTKDM6BKDM5C
SCHEMBL7652425 0.73 ALDH1A1 (0.39)
SCHEMBL5360455 0.72 EGLN1 (0.41) EGLN1ABCC4MAPTKDM6BKDM5C
SCHEMBL9576196 0.71 HCAR2 (0.37) EGLN1
SCHEMBL11896929 0.69 ALDH1A1 (0.35)
SCHEMBL27457162 0.69 MAPT (0.35) EGLN1ABCC4MAPTKDM6BKDM5C
SCHEMBL8754818 0.67 MAPT (0.31) MAPT
SCHEMBL18747596 0.66 EGLN1 (0.46) EGLN1KDM6BKDM5CPHF8KDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5286876-A None JP disclosed
US-5342488-A Separation of 1,4-butanediol from hydrogenation mixtures BASF AKTIENGESELLSCHAFT (DE) 1994-08-30 US disclosed
US-5342488-A Separation of 1,4-butanediol from hydrogenation mixtures BASF AKTIENGESELLSCHAFT (DE) 1994-08-30 US disclosed
JP-H05286876-A SEPARATION OF 1,4-BUTANEDIOL FROM HYDROGENATION MIXTURE BASF AG 1993-11-02 JP disclosed
EP-0557786-A1 Method of separation of 1,4-butanediol from hydrogenation mixtures BASF Aktiengesellschaft (DE) 1993-09-01 EP disclosed