SCHEMBL17104366

SCHEMBL17104366

Nc1cc(SCC(F)(F)F)ccc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.37
KIF11 P52732 2/20 0.36
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
G6PD P11413 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11630507 0.83 ALDH1A1 (0.36) TSHRKDM4EALDH1A1MEN1USP2
SCHEMBL15072593 0.80 TDP1 (0.31) KDM4EALDH1A1MAPTHSD17B10TDP1
SCHEMBL8178183 0.79 KIF11 (0.40) ARKIF11GLAPOLBGAA
SCHEMBL15058751 0.79 TSHR (0.41) GAATSHRKDM4EALDH1A1PDE7A
SCHEMBL17104361 0.79 ALDH1A1 (0.41) TSHRKDM4EALDH1A1MAPTALOX15
SCHEMBL17104363 0.76
SCHEMBL25250142 0.76 KIF11 (0.38) ARKIF11GLAPOLBGAA
SCHEMBL17104356 0.75 AR (0.46) ARGLAGAAKDM4EMAPT
SCHEMBL28077949 0.73 ALDH1A1 (0.33) KDM4EALDH1A1TDP1
SCHEMBL8034515 0.72 ALDH1A1 (0.52) KIF11GAATSHRKDM4EALDH1A1

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
EP-2099748-B1 INSECTICIDAL BENZAMIDINES BAYER IP GMBH (DE) 2015-09-30 EP disclosed