SCHEMBL8726233

SCHEMBL8726233

CCCCCC1CCC(c2ccc(F)cc2)(C2(C(=O)O)CCCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KCNH2 Q12809 1/20 0.36
CACNA1I Q9P0X4 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CACNA1G O43497 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
GPR119 Q8TDV5 1/20 0.35
CYP1A2 P05177 1/20 0.35
TRPA1 O75762 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL8727353 0.92 HSD11B1 (0.43) HSD11B1MEN1KMT2AKCNH2CACNA1I
SCHEMBL8726981 0.88 SLC6A4 (0.39) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL8729401 0.86 SLC6A4 (0.43) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL8410642 0.81 GRM2 (0.39) HSD11B1SLC6A2SLC6A4SLC6A3TP53
SCHEMBL7511127 0.81 MEN1 (0.48) HSD11B1MEN1KMT2AKCNH2CACNA1I
SCHEMBL7507869 0.80 MEN1 (0.47) HSD11B1MEN1KMT2AKCNH2CACNA1I
SCHEMBL8725824 0.80 SLC6A4 (0.39) HSD11B1MEN1KMT2ASLC6A2SLC6A4
SCHEMBL9797584 0.79 CYP1A2 (0.50) MEN1KMT2ATP53MAPTCYP1A2
SCHEMBL10435336 0.79 CYP1A2 (0.44) MEN1KMT2ATP53MAPTGPR119
SCHEMBL8729811 0.78 SLC6A4 (0.43) MEN1KMT2ASLC6A2SLC6A4SLC6A3

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-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed