SCHEMBL6785281

SCHEMBL6785281

CCC(Sc1ccc(O)cc1)(C(=O)O)c1ccc(OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.40
LTA4H P09960 1/20 0.40
CALM1 P0DP23 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
MAPT P10636 2/20 0.38
KCNK2 O95069 1/20 0.38
CTBP2 P56545 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.38
APEX1 P27695 1/20 0.38
MAPK1 P28482 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
APP P05067 1/20 0.37

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
SCHEMBL6786095 0.83 ESR1 (0.39) ESR2KCNK2ALDH1A1LMNAKIF11
SCHEMBL6784818 0.83 ESR1 (0.42) ESR2GAAMAPTKCNK2ALDH1A1
SCHEMBL6786562 0.83 HSP90AA1 (0.40) ESR2GAAMAPTKCNK2ALDH1A1
SCHEMBL6782624 0.82 ADAM17 (0.49) PKMALDH1A1LMNATDP1
SCHEMBL6782872 0.76 KMT2A (0.40) GAAMAPTALDH1A1LMNAHSD17B10
SCHEMBL6782115 0.75 FFAR1 (0.37) LTA4H
SCHEMBL6785959 0.74 KIF11 (0.39) ESR2PKMCTBP2KIF11ESR1
SCHEMBL6785653 0.71 ADAM17 (0.49)
SCHEMBL3173618 0.71 ESR2 (0.55) ESR2LTA4HCALM1GAAPKM
SCHEMBL8760915 0.71 ESR1 (0.73) ESR2LTA4HCALM1GAAPKM

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
US-6825354-B2 OSTEOPOROSIS; RHEUMATIC DISEASES WYETH HOLDINGS CORPORATION 2004-11-30 US disclosed