SCHEMBL11133096

SCHEMBL11133096

C=CC(C#N)Sn1cnc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.36
▸ HTT P42858 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ AGER Q15109 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ TNF P01375 1/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ FGFR1 P11362 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ GGPS1 O95749 1/20 0.31
▸ FDPS P14324 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ STAT6 P42226 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
SCHEMBL14722522 0.75 TDP1 (0.44) TDP1HTTHSD17B10MEN1HPGD
SCHEMBL11497311 0.74 TDP1 (0.39) TDP1HTTHSD17B10MEN1HPGD
SCHEMBL8412995 0.73 MEN1 (0.47) TDP1HTTHSD17B10MEN1HPGD
SCHEMBL11451311 0.69 TDP1 (0.46) TDP1HTTAGERPOLBTNF
SCHEMBL273486 0.69 TDP1 (0.52) TDP1HTTHSD17B10MEN1HPGD
SCHEMBL8013907 0.69 TDP1 (0.52) TDP1HTTHSD17B10MEN1HPGD
SCHEMBL1939000 0.68 TDP1 (0.44) TDP1HTTMEN1KMT2APOLB
SCHEMBL11882314 0.67 ASAH1 (0.48) HTTHSD17B10MEN1HPGDKMT2A
SCHEMBL1879818 0.66 HTT (0.48) TDP1HTTHSD17B10MEN1HPGD
SCHEMBL3805246 0.66 TDP1 (0.42) TDP1HTTMEN1KMT2APOLB

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-0006347-B1 COMPOSITIONS AND METHOD FOR REGULATING SOYBEAN PLANT GROWTH UTILIZING SUBSTITUTED BENZAZOLYLTHIOALKANOIC ACIDS MONSANTO COMPANY (US) 1984-01-25 — — EP disclosed
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