SCHEMBL8732012

SCHEMBL8732012

CCOP(=O)(COS(=O)(=O)c1c(Cl)cccc1Cl)OCC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.33
CXCR2 P25025 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 3/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KCNH2 Q12809 1/20 0.32
POLB P06746 2/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL8734627 0.92 SLC40A1 (0.33) HSD17B10MEN1KMT2ATSHRKDM4E
SCHEMBL8734615 0.89 HSD17B10 (0.34) HSD17B10MEN1KMT2ATSHRKDM4E
SCHEMBL8734825 0.88 ELANE (0.34) HSD17B10MEN1KMT2AKDM4ELMNA
SCHEMBL27289740 0.88 PNMT (0.38) HSD17B10MEN1KMT2A
SCHEMBL8735611 0.87 HSD17B10 (0.33) HSD17B10MEN1KMT2A
SCHEMBL8764586 0.85 CXCR2 (0.32) CXCR2KDM4EPOLB
SCHEMBL8732411 0.85 SLC40A1 (0.32) HSD17B10MEN1KMT2ALMNAALDH1A1
SCHEMBL8731843 0.85 HSD17B10 (0.37) HSD17B10NPSR1KDM4ELMNAALDH1A1
SCHEMBL8731903 0.82 NR3C1 (0.33) HSD17B10MEN1KMT2ATSHRSMN1; SMN2
SCHEMBL8731819 0.81 ELANE (0.32) HSD17B10MEN1KMT2A

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-0699390-B1 Compositions containing phosphosulfonate herbicides and dichloroacetamide safeners, and method of use ROHM & HAAS (US) 1998-10-07 EP claimed