SCHEMBL7672709

SCHEMBL7672709

CCOc1ccc(CCNC(=O)C(NSC)c2ccc(Cl)c(Cl)c2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
CNR1 P21554 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL7669288 0.90 ALDH1A1 (0.42) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL7675476 0.89 ALDH1A1 (0.43) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL7676614 0.89 ALDH1A1 (0.44) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL7677540 0.87 LMNA (0.50) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL9060152 0.85 ALDH1A1 (0.50) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL7675428 0.78 LMNA (0.61) LMNAALDH1A1KMT2AMAPTCA1
SCHEMBL7668449 0.78 SMN1; SMN2 (0.58) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL7674397 0.76 KMT2A (0.46) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL7676013 0.76 ALDH1A1 (0.50) LMNAALDH1A1KMT2AMEN1MAPT
SCHEMBL6227895 0.76 ALDH1A1 (0.44) LMNAALDH1A1KMT2AMEN1MAPT

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-6479550-B1 α-sulfenimino acid derivatives SYNGENTA CROP PROTECTION, INC. 2002-11-12 US claimed