SCHEMBL8854480

SCHEMBL8854480

O=[PH2]OCOS(=O)(=O)c1ccccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.35
PRSS2 P07478 1/20 0.35
HSD11B1 P28845 2/20 0.35
PGR P06401 3/20 0.35
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NFE2L2 Q16236 5/20 0.34
KCNH2 Q12809 1/20 0.33

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
SCHEMBL8854619 0.81 KMT2A (0.31) GAAALDH1A1
SCHEMBL8854664 0.81 MCL1 (0.41) GAATSHRALDH1A1L3MBTL1
SCHEMBL8712194 0.77 HSD11B1 (0.43) F2PRSS2HSD11B1PGRGAA
SCHEMBL27297313 0.77 HSD11B1 (0.35) F2HSD11B1PGRGAATSHR
SCHEMBL27468777 0.77 F2 (0.36) F2HSD11B1PGRGAATSHR
SCHEMBL8854508 0.76 ALDH1A1 (0.33) GAAALDH1A1
SCHEMBL8854709 0.76 MEN1 (0.43) HSD11B1ALDH1A1
SCHEMBL8854634 0.75 SLC40A1 (0.35) TSHRALDH1A1
SCHEMBL8854545 0.74 F2 (0.37) F2PRSS2HSD11B1PGRALDH1A1
SCHEMBL8854547 0.74 MEN1 (0.32) HSD11B1

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
US-5693590-A PLANT GROWTH REGULATOR ROHM AND HAAS COMPANY (US) 1997-12-02 US claimed