SCHEMBL8892557

SCHEMBL8892557

CCSc1ccc(C(=O)Cl)c(Cc2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.41
PTPN2 P17706 1/20 0.41
PTPN6 P29350 1/20 0.41
MCL1 Q07820 1/20 0.38
BCL2A1 Q16548 1/20 0.38
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
BCL2 P10415 1/20 0.37
BCL2L1 Q07817 1/20 0.37
PTGS2 P35354 1/20 0.36
TBXA2R P21731 1/20 0.36
PTGER3 P43115 1/20 0.36
PTGER2 P43116 1/20 0.36

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
SCHEMBL8899593 0.78 MBTD1 (0.35) PTPN1PTPN2PTPN6MCL1BCL2A1
SCHEMBL27825242 0.78 CYP3A4 (0.48) PTPN1PTPN2PTPN6MEN1CYP3A4
SCHEMBL8891694 0.74 CCR5 (0.35) PTPN1PTPN2PTPN6CYP3A4ALOX15
SCHEMBL8900596 0.74 PTPN1 (0.34) PTPN1PTPN2PTPN6HPGDPTGS2
SCHEMBL1462173 0.73 TSHR (0.58) PTPN1PTPN2PTPN6CYP3A4ALOX15
SCHEMBL8891189 0.73 PTPN1 (0.34) PTPN1PTPN2PTPN6PTGS2FFAR4
SCHEMBL9172151 0.70 PTGDR2 (0.41) PTGS2SMN1; SMN2
SCHEMBL3537683 0.70 KDM4E (0.44) MEN1CYP3A4HPGDKMT2AHSD17B10
SCHEMBL979351 0.68 HPGD (0.62) PTPN1PTPN2PTPN6MEN1CYP3A4
SCHEMBL1017894 0.68 SMN1; SMN2 (0.56) MCL1MEN1CYP3A4KMT2AHIF1A

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
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed