SCHEMBL6336245

SCHEMBL6336245

CC1(C)CCC(C)(C)c2cc3c(C(F)(F)F)cc(=O)oc3cc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 15/20 0.56
PGR P06401 8/20 0.56
NR3C2 P08235 3/20 0.56
MCL1 Q07820 1/20 0.55
HSD17B3 P37058 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
SRC P12931 1/20 0.49
HPGD P15428 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
KMT2A Q03164 1/20 0.49
ATM Q13315 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TLR9 Q9NR96 1/20 0.49
MAP2K1 Q02750 1/20 0.45
NR3C1 P04150 2/20 0.44

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
SCHEMBL2859774 0.72 AR (1.00) ARPGRNR3C2
SCHEMBL23567196 0.71 MEN1 (0.49) ARPGRNR3C2MCL1HSD17B3
SCHEMBL31281560 0.71 MEN1 (0.49) ARPGRNR3C2MCL1HSD17B3
SCHEMBL31955647 0.71 MCL1 (1.00) ARPGRNR3C2MCL1HSD17B3
SCHEMBL592629 0.71 MCL1 (1.00) ARPGRNR3C2MCL1HSD17B3
SCHEMBL592396 0.71 MCL1 (0.59) ARPGRNR3C2MCL1HSD17B3
SCHEMBL5231375 0.71 AR (0.75) ARPGRNR3C2MCL1ATM
SCHEMBL20777005 0.70 CASP1 (0.59) ARPGRNR3C2MCL1HSD17B3
SCHEMBL12611304 0.69 ALDH1A1 (0.67) ARMCL1HSD17B3KDM4EMEN1
SCHEMBL236736 0.69 AR (0.74) ARHSD17B3KDM4EMEN1ALDH1A1

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-6884820-B2 5,6,7,8-tetrahydronaphthalen-2-yl-7-fluoroalkyl-heptatrienoic acid derivatives having serum glucose reducing activity ALLERGAN, INC. (US) 2005-04-26 US disclosed
US-20040198825-A1 5,6,7,8-Tetrahydronaphthalen-2-yl-7-fluoroalkyl-heptatrienoic acid derivatives having serum glucose reducing activity ALLERGAN, INC. 2004-10-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040198825-A1 5,6,7,8-Tetrahydronaphthalen-2-yl-7-fluoroalkyl-heptatrienoic acid derivatives having serum glucose reducing activity TPO, TTR, FABP1 AR 2046/4885PGR 3385/4885NR3C2 113/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.