SCHEMBL28488463

SCHEMBL28488463

CCCC(=O)c1cc(C)cc(C(=O)CCC)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.57
TSHR P16473 2/20 0.57
ALDH1A1 P00352 1/20 0.57
HPGD P15428 1/20 0.57
ALOX15 P16050 1/20 0.57
RECQL P46063 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
HSD17B3 P37058 1/20 0.44
FASN P49327 2/20 0.44
TCF4 P15884 1/20 0.43
CTNNB1 P35222 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NR2F2 P24468 1/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.39
HMGCR P04035 1/20 0.39
FFAR1 O14842 1/20 0.38
PLA2G2A P14555 1/20 0.38
PLA2G5 P39877 1/20 0.38

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
SCHEMBL11067998 0.87 ALDH1A1 (0.49) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL7304310 0.83 HPGD (0.57) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL11073436 0.82 GPR35 (0.59) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL11074148 0.79 HPGD (0.61) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL30496176 0.78 NR2F2 (0.41) ALDH1A1MEN1KMT2ANR2F2HTT
SCHEMBL946114 0.78 ALDH1A1 (0.66) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL25170495 0.76 ALDH1A1 (0.58) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL11559830 0.76 HMGB1 (0.46) HSD17B10ALDH1A1HPGDMEN1KMT2A
SCHEMBL5568822 0.76 MEN1 (0.71) HSD17B10TSHRALDH1A1HPGDALOX15
SCHEMBL11559382 0.76 ALDH1A1 (0.49) HSD17B10TSHRALDH1A1HPGDALOX15

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
CN-111511779-A Components and catalysts for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2020-08-07 CN disclosed