SCHEMBL7966485

SCHEMBL7966485

Fc1cccc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 4/20 0.43
PTPN1 P18031 1/20 0.37
KIF11 P52732 1/20 0.37
CYP19A1 P11511 2/20 0.36
ACHE P22303 1/20 0.35
NFE2L2 Q16236 2/20 0.34
MGLL Q99685 1/20 0.33
MTOR P42345 1/20 0.33
MAPK1 P28482 2/20 0.32
TSHR P16473 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
PKM P14618 1/20 0.31
THPO P40225 1/20 0.31
NPC1 O15118 1/20 0.31
CHRM5 P08912 1/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL21367600 0.85 PGK1 (0.40) KIF11MGLLMAPK1TSHRCES2
SCHEMBL9651762 0.78 TSHR (0.59) MAPK1TSHRCYP3A4LMNAMAOB
SCHEMBL5165261 0.78 ALDH1A1 (0.41) KIF11ACHETSHRCES2CYP3A4
SCHEMBL2263254 0.78 TSHR (0.59) MAPK1TSHRCYP3A4LMNAMAOB
SCHEMBL15319724 0.78 TSHR (0.59) MAPK1TSHRCYP3A4LMNAMAOB
SCHEMBL24473266 0.78 PGK1 (0.41) KIF11ACHEMGLLMAPK1TSHR
SCHEMBL11584197 0.77 NR1H3 (0.42) MAPK1TSHR
SCHEMBL10453463 0.76 TSHR (0.48) KCNN4PTPN1KIF11MAPK1TSHR
SCHEMBL15320774 0.76 TSHR (0.48) KCNN4PTPN1KIF11MAPK1TSHR
SCHEMBL9800786 0.76 TSHR (0.48) KCNN4PTPN1KIF11MAPK1TSHR

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-6326337-B1 OXIDATION AND CORROSION RESISTANCE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2001-12-04 US disclosed