SCHEMBL9706657

SCHEMBL9706657

O=C(O)c1cc(-n2c(=O)[nH]c(CF)c(F)c2=O)c(F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.36
GNRHR P30968 6/20 0.34
KDM4E B2RXH2 1/20 0.32
MYC P01106 1/20 0.32
NR4A1 P22736 1/20 0.32
CTSB P07858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTT P42858 1/20 0.31
EPHX2 P34913 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9706685 0.83 HPGD (0.35) GNRHRKDM4EMEN1ALDH1A1LMNA
SCHEMBL9706663 0.82 NOTUM (0.40) NOTUMGNRHRKDM4EMYCNR4A1
SCHEMBL9706638 0.82 NOTUM (0.34) NOTUMGNRHRMYCNR4A1CTSB
SCHEMBL9706705 0.80 NOTUM (0.37) NOTUMGNRHRKDM4EMYCNR4A1
SCHEMBL9706646 0.76 NOTUM (0.37) NOTUMMYCNR4A1CTSBTDP1
SCHEMBL10575583 0.76 PPOX (0.45) GNRHRTDP1HTTMEN1KMT2A
SCHEMBL9706673 0.75 HPGD (0.40) KDM4ETDP1EPHX2MEN1ALDH1A1
SCHEMBL9706536 0.75 HPGD (0.38) KDM4ETDP1HTTEPHX2MEN1
SCHEMBL9706539 0.75 SMN1; SMN2 (0.45) NOTUMMYCNR4A1CTSBTDP1
SCHEMBL9706655 0.75 TSHR (0.34) NOTUMKDM4EMYCNR4A1CTSB

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-0195346-B1 3-ARYL URACILES AND THEIR USE AS HERBICIDES CIBA-GEIGY AG (CH) 1992-06-24 EP claimed