SCHEMBL9724032

SCHEMBL9724032

CCOC(=O)C1CSCN1C(=O)Cc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.36
TSHR P16473 3/20 0.35
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.35
KCNT1 Q5JUK3 1/20 0.35
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.34
PREP P48147 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ACE P12821 1/20 0.34

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
SCHEMBL9724034 0.88 KMT2A (0.50) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9724048 0.88 ALDH1A1 (0.40) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9724043 0.85 TSHR (0.42) KMT2AMEN1SMN1; SMN2TSHRMAPK1
SCHEMBL9724030 0.83 POLB (0.36) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9387086 0.82 OPRK1 (0.34) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9724045 0.81 KMT2A (0.61) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9724038 0.81 KMT2A (0.39) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL8876253 0.79 KMT2A (0.38) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8983664 0.79 VHL (0.40) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9727276 0.79 KMT2A (0.53) KMT2AMEN1SMN1; SMN2GAATSHR

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-5116836-A Herbicides, insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed