SCHEMBL10436701

SCHEMBL10436701

FC(Cl)(Cl)C(F)(F)c1cnc(Cl)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
POLB P06746 2/20 0.38
PLAU P00749 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 3/20 0.37
HTT P42858 3/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HPGD P15428 2/20 0.37
XBP1 P17861 1/20 0.37
GAA P10253 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.34
GLA P06280 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL10353556 0.88 ALDH1A1 (0.40) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL7893865 0.86 ALDH1A1 (0.41) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL10349184 0.83 ALDH1A1 (0.42) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL10349447 0.83 ALDH1A1 (0.42) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL1747710 0.83 TSHR (0.44) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL29504068 0.83 TSHR (0.44) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL120994 0.81 ALDH1A1 (0.56) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL29414916 0.81 ALDH1A1 (0.56) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL8957637 0.81 ALDH1A1 (0.41) ALDH1A1POLBPLAUKDM4ESMN1; SMN2
SCHEMBL8773497 0.81 ALDH1A1 (0.39) ALDH1A1POLBPLAUKDM4ESMN1; SMN2

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-0397601-A1 Benzoylphenylureas CIBA-GEIGY AG (CH) 1990-11-14 EP claimed
EP-0397601-A1 Benzoylphenylureas CIBA-GEIGY AG (CH) 1990-11-14 EP disclosed
US-4638069-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1987-01-20 US disclosed
US-4577028-A 5-Haloalkyl-pyridines CIBA-GEIGY CORPORATION (US) 1986-03-18 US disclosed
US-4550108-A 1,3,5-Oxadiazine-2,4-diones and pesticidal use CIBA GEIGY CORPORATION (US) 1985-10-29 US disclosed
US-4511571-A N-(2-Pyridyloxyphenyl)-N'-benzoyl ureas, pesticidal compositions containing same and pesticidal methods of use CIBA GEIGY CORPORATION (US) 1985-04-16 US disclosed