SCHEMBL7301115

SCHEMBL7301115

[O]c1cc(O)c(O)c2c(O)cccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
ALOX15 P16050 3/20 0.46
RECQL P46063 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
MAPT P10636 3/20 0.46
THRB P10828 2/20 0.46
SNCA P37840 2/20 0.46
APP P05067 1/20 0.46
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
DNMT1 P26358 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
MCL1 Q07820 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
CDK2 P24941 5/20 0.40

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
SCHEMBL4635862 0.80 HPGD (0.58) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL31037128 0.80 HPGD (0.58) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL18716074 0.74 HPGD (0.62) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL18716135 0.72 HPGD (0.59) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL31256488 0.72 HPGD (0.59) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL3220975 0.71 HPGD (0.58) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL7306511 0.71 PIM1 (0.43) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL11539587 0.70 HPGD (0.56) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL7299430 0.70 HPGD (0.70) HPGDALOX15RECQLHSD17B10TDP1
SCHEMBL18068458 0.70 HPGD (0.56) HPGDALOX15RECQLHSD17B10TDP1

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-5629406-A AMINO ACID DERIVATIVES SANKYO COMPANY, LIMITED (JP) 1997-05-13 US disclosed
EP-0587311-A1 Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1994-03-16 EP disclosed