SCHEMBL15516575

SCHEMBL15516575

C[C](C)c1cc(C(F)(F)F)nc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.42
▸ HSP90AB1 P08238 1/20 0.42
▸ CYP2D6 P10635 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GPBAR1 Q8TDU6 3/20 0.34
▸ HSD17B10 Q99714 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ MDM2 Q00987 1/20 0.33

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
SCHEMBL30989545 0.82 CA5A (0.43) HSP90AA1HSP90AB1LMNAALDH1A1MEN1
SCHEMBL15561973 0.75 CES2 (0.58) MAPTMEN1KMT2AGAACES2
SCHEMBL12098246 0.74 ALOX15 (0.48) TSHRCES2
SCHEMBL24746798 0.74 MEN1 (0.35) HSP90AA1HSP90AB1LMNAPOLBMAPT
SCHEMBL27287645 0.73 HSP90AA1 (0.37) HSP90AA1HSP90AB1CYP2D6CYP3A4TSHR
SCHEMBL29229012 0.73 MEN1 (0.34) HSP90AA1HSP90AB1LMNAPOLBMAPT
SCHEMBL795085 0.73 HSP90AA1 (0.35) HSP90AA1HSP90AB1CYP2D6CYP3A4TSHR
SCHEMBL30238177 0.73 CDK8 (0.43) HSP90AA1HSP90AB1CYP3A4ALDH1A1KMT2A
SCHEMBL8446958 0.72 HSP90AA1 (0.41) HSP90AA1HSP90AB1CYP2D6CYP3A4TSHR
SCHEMBL10271821 0.72 HSP90AA1 (0.52) HSP90AA1HSP90AB1CYP2D6CYP3A4TSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2887802-A2 METHODS OF SOIL PEST CONTROL Syngenta Participations AG (CH) 2015-07-01 — — EP disclosed
WO-2014029708-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 — — WO disclosed
WO-2014029706-A2 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 — — WO disclosed
WO-2014029710-A2 METHODS OF SOIL PEST CONTROL SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 — — WO disclosed
WO-2014029707-A1 METHODS OF CONTROLLING INSECTS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-27 — — WO disclosed
WO-2014019609-A1 METHODS OF PEST CONTROL IN SOYBEAN SYNGENTA PARTICIPATIONS AG (CH) 2014-02-06 — — WO disclosed
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