SCHEMBL7553442

SCHEMBL7553442

CCNc1c(C(=O)c2cnoc2C2CC2)ccc(SC)c1F

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.35
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 1/20 0.31
EPHX2 P34913 1/20 0.31
CRACR2A Q9BSW2 2/20 0.31
AR P10275 1/20 0.31
NAMPT P43490 1/20 0.30
PDE2A O00408 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
SCHEMBL7555059 0.88 HPGD (0.35) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL7556089 0.87 DHODH (0.38) DHODHTAS1R3TAS1R1TAS1R2EPHX2
SCHEMBL7558174 0.85 DHODH (0.36) DHODHHPGD
SCHEMBL8925091 0.80 DHODH (0.33) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL7554574 0.79 DHODH (0.33) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL7558187 0.79 DHODH (0.35) DHODHTAS1R3TAS1R1TAS1R2EPHX2
SCHEMBL7550434 0.78 DHODH (0.31) DHODH
SCHEMBL7550407 0.78 DHODH (0.38) DHODHHPGDRAB9AEPHX2CRACR2A
SCHEMBL9069970 0.77 DHODH (0.36) DHODHHPGDALDH1A1CASP3RAB9A
SCHEMBL7559589 0.77 NPC1 (0.36) DHODHRAB9ATAS1R3TAS1R1TAS1R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734380-B1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD (GB) 2002-07-10 EP disclosed
US-6369270-B1 CHEMICAL INTERMEDIATES RHONE POULENC AGRICULTURE LIMITED (GB) 2002-04-09 US disclosed
US-6114538-A 2-POSITION OF BENZOY RING OF 4-BENZOYLISOXAZOLE DERIVATIVE IS SUBSTITUTED AND PARTICULARLY USED AGAINST MONOCOTYLEDONOUS WEEDS BY POST-EMEREGENECE APPLICATION RHONE POULENC AGRICULTURE LIMITED (GB) 2000-09-05 US disclosed
US-5998653-A CHEMICAL INTERMEDIATE FOR HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1999-12-07 US disclosed
US-5658858-A POSTEMERGENCE HERBICIDES RHONE-POULENC ARGRICULTURE LIMITED (GB) 1997-08-19 US disclosed
EP-0734380-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1996-10-02 EP disclosed
WO-1995016678-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1995-06-22 WO disclosed