SCHEMBL7950315

SCHEMBL7950315

Cc1cc(C(=O)CCCl)c(O)c(C)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 1/20 0.37
UBE2N P61088 1/20 0.37
HMGB1 P09429 1/20 0.36
CXCL12 P48061 1/20 0.36
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
NR2F2 P24468 1/20 0.33
PSMD14 O00487 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MMP2 P08253 1/20 0.33
GAA P10253 1/20 0.33
THRB P10828 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
SCHEMBL23882900 0.83 POLB (0.35) MAPTHSD17B10KDM4EUBE2NTDP1
SCHEMBL30251155 0.83 POLB (0.35) MAPTHSD17B10KDM4EUBE2NTDP1
SCHEMBL10607897 0.79 MAPT (0.40) MAPTHSD17B10KDM4EUBE2NHMGB1
SCHEMBL865601 0.78 MEN1 (0.36) HSD17B10TDP1ALDH1A1HPGDALOX15
SCHEMBL20554715 0.76 ALDH1A1 (0.52) MAPTHSD17B10KDM4ETDP1ALDH1A1
SCHEMBL30132596 0.76 ALDH1A1 (0.52) MAPTHSD17B10KDM4ETDP1ALDH1A1
SCHEMBL30132562 0.75 SHBG (0.55) MAPTHSD17B10ALDH1A1ALOX15MEN1
SCHEMBL20554833 0.75 SHBG (0.55) MAPTHSD17B10ALDH1A1ALOX15MEN1
SCHEMBL15483655 0.74 ALDH1A1 (0.40) MAPTHSD17B10KDM4EUBE2NHMGB1
SCHEMBL4126506 0.72 HMGB1 (0.57) MAPTHSD17B10KDM4EHMGB1CXCL12

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
US-6258827-B1 HYDROXYAROMATIC HETEROCYCLIC ALKANOLS AND LEVODOPA PFIZER INC. 2001-07-10 US disclosed
US-6046213-A Neuroprotective 3-(piperidinyl-1)-chroman-4,7-diol and 1-(4-hydroxyphenyl)-2-(piperidinyl-1)-alkanol derivatives PFIZER INC. (US) 2000-04-04 US disclosed