SCHEMBL8650429

SCHEMBL8650429

O=C(CCCCCC(=O)Oc1cc(O)c(F)c(O)c1)Oc1cc(O)c(F)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
ELANE P08246 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL25797752 0.85 KMT2A (0.44) KMT2AALDH1A1SMN1; SMN2ELANECNR2
SCHEMBL16582359 0.83 KMT2A (0.44) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8650698 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8651624 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8655657 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8653636 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8653974 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8653228 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8652802 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1
SCHEMBL8653229 0.82 KMT2A (0.47) KMT2APRSS1PRSS2PRSS3ALDH1A1

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
EP-0688759-B1 Alpha-resorcylic acid ester derivatives and recording materials incorporating them FUJI PHOTO FILM CO LTD (JP) 1998-10-07 EP disclosed
EP-0688759-A1 Alpha-resorcylic acid ester derivatives and recording materials incorporating them FUJI PHOTO FILM CO., LTD. (JP) 1995-12-27 EP disclosed