SCHEMBL7616307

SCHEMBL7616307

Cc1cc(O)c(C(O)CCC(C)C)c(=O)o1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
MCL1 Q07820 2/20 0.46
ALDH1A1 P00352 2/20 0.42
ELANE P08246 2/20 0.40
KMT2A Q03164 7/20 0.40
MEN1 O00255 6/20 0.40
HTT P42858 1/20 0.40
ANTXR2 P58335 1/20 0.37
MAOA P21397 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PTGES O14684 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BCL2 P10415 1/20 0.35
GLA P06280 1/20 0.33
CYP3A4 P08684 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 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
SCHEMBL800045 0.78 MAPT (0.54) MAPTMCL1ALDH1A1ELANEKMT2A
SCHEMBL11793142 0.71 ELANE (0.37) MAPTMCL1ALDH1A1ELANEKMT2A
SCHEMBL131729 0.71 ELANE (0.63) MAPTALDH1A1ELANEKMT2AMEN1
SCHEMBL11789742 0.70 GAA (0.47) MAPTMCL1ALDH1A1ELANEKMT2A
SCHEMBL6174518 0.69 VKORC1 (0.55) MAPTMCL1ALDH1A1KMT2AMEN1
SCHEMBL11798260 0.69 ELANE (0.41) MAPTMCL1ALDH1A1ELANEKMT2A
SCHEMBL6026870 0.68 ELANE (0.46) MAPTALDH1A1ELANEKMT2AMEN1
SCHEMBL20881779 0.67 SYNJ2 (0.39) MAPTMCL1ALDH1A1ELANEKMT2A
SCHEMBL6174415 0.67 CYP2C9 (0.58) MAPTMCL1ALDH1A1KMT2AMEN1
SCHEMBL6173554 0.67 MAPT (0.47) MAPTMCL1ALDH1A1ELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002255956-A ANTIFUNGAL AGENT SUMITOMO CHEM CO LTD 2002-09-11 JP disclosed