SCHEMBL9567015

SCHEMBL9567015

Cn1c(C(F)(F)F)cc(=O)n(-c2ccc(Cl)c(C(=O)C3CCCC3)c2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSB P07858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NOTUM Q6P988 11/20 0.34
CFTR P13569 1/20 0.34
CRHR1 P34998 1/20 0.33
P2RX7 Q99572 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PDK2 Q15119 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
SCHEMBL9567019 0.99 CFTR (0.35) CTSBTDP1SMN1; SMN2NOTUMCFTR
SCHEMBL9567016 0.96 CTSB (0.36) CTSBTDP1SMN1; SMN2NOTUMCRHR1
SCHEMBL9168174 0.83 TDP1 (0.40) CTSBTDP1SMN1; SMN2NOTUMCRHR1
SCHEMBL9423041 0.83 TDP1 (0.40) CTSBTDP1SMN1; SMN2NOTUMP2RX7
SCHEMBL29576263 0.83 TDP1 (0.40) CTSBTDP1SMN1; SMN2NOTUMCRHR1
SCHEMBL1807362 0.83 TDP1 (0.52) CTSBTDP1NOTUMMEN1KMT2A
SCHEMBL6465173 0.82 LMNA (0.47) CTSBTDP1NOTUMP2RX7MEN1
Ethylene SCHEMBL9423310 0.81 TDP1 (0.39) CTSBTDP1NOTUMP2RX7MEN1
SCHEMBL8993584 0.81 MEN1 (0.37) CRHR1MEN1KMT2A
SCHEMBL9423187 0.81 TDP1 (0.38) CTSBTDP1NOTUMCRHR1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542685-A1 3-Aryluracile derivatives and their use against weeds CIBA-GEIGY AG (CH) 1993-05-19 EP claimed
EP-0542685-A1 3-Aryluracile derivatives and their use against weeds CIBA-GEIGY AG (CH) 1993-05-19 EP disclosed