SCHEMBL9497433

SCHEMBL9497433

CC(C)=NOC(=O)c1cc(-n2c(=O)cc(C)n(C(F)F)c2=O)c(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA9 Q16790 3/20 0.39
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
HPGD P15428 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
MAPT P10636 3/20 0.32
PKM P14618 2/20 0.32
ALOX15 P16050 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 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
SCHEMBL9495959 0.91 HPGD (0.32) CA12CA1CA2CA9NPC1
SCHEMBL9523542 0.86 MAPT (0.35) HPGDSMN1; SMN2MAPTLMNA
SCHEMBL9521572 0.85 LMNA (0.34) HPGDSMN1; SMN2MAPTL3MBTL1LMNA
SCHEMBL9494830 0.83 NOTUM (0.38) HPGDSMN1; SMN2PKML3MBTL1
SCHEMBL9495601 0.83 TDP1 (0.39) CA12CA1CA2CA9NPC1
SCHEMBL9522926 0.81 FNTA (0.38) NPC1HPGDSMN1; SMN2MAPTLMNA
SCHEMBL9796398 0.81 LMNA (0.34) HPGDSMN1; SMN2MAPTLMNA
SCHEMBL9796159 0.80 BAZ2B (0.34) HPGDSMN1; SMN2MAPTLMNA
SCHEMBL9494826 0.78 CA12 (0.39) CA12CA1CA2CA9NPC1
SCHEMBL9495723 0.77 CA12 (0.32) CA12CA1CA2CA9NPC1

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-0344232-B1 3-ARYLURACILS FOR KILLING WEEDS CIBA-GEIGY AG (CH) 1993-03-24 EP disclosed
US-5041156-A 3-aryluracils for the control of weeds CIBA-GEIGY CORPORATION (US) 1991-08-20 US disclosed