SCHEMBL8637291

SCHEMBL8637291

CCOC(=O)C(Cl)=Cc1cccc(N2C(=O)C3=C(CC(Cl)CC3)C2=O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ ATM Q13315 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MAPT P10636 3/20 0.34
▸ PDCD1 Q15116 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ GLO1 Q04760 1/20 0.33
▸ LMNA P02545 2/20 0.33
▸ S1PR4 O95977 1/20 0.33
▸ S1PR1 P21453 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL8926263 0.76 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1ATMSMN1; SMN2
SCHEMBL8646877 0.75 PRMT1 (0.51) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL39177 0.71 MAPT (0.37) ALDH1A1KMT2AMAPTCASP3MAPK1
SCHEMBL5467830 0.71 MAPT (0.37) ALDH1A1KMT2AMAPTCASP3MAPK1
SCHEMBL8638850 0.70 GAA (0.36) ALDH1A1KMT2AMEN1ATMSMN1; SMN2
SCHEMBL5747001 0.67 MEN1 (0.72) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL4803624 0.67 MEN1 (0.72) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL8897906 0.65 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1MAPTCASP3
SCHEMBL8897908 0.65 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1MAPTCASP3
SCHEMBL9629059 0.65 PRMT1 (0.45) ALDH1A1KMT2AMEN1MAPT

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-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 — — US disclosed
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