SCHEMBL7657974

SCHEMBL7657974

COc1cc(OC)c(NC(=S)Nc2cccc(C(N)=O)c2Cl)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.68
MEN1 O00255 5/20 0.68
NPSR1 Q6W5P4 1/20 0.68
MAPT P10636 8/20 0.60
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
ALDH1A1 P00352 9/20 0.58
HPGD P15428 3/20 0.58
LMNA P02545 2/20 0.54
KDM4E B2RXH2 4/20 0.53
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
POLB P06746 1/20 0.49
HTT P42858 2/20 0.48

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
SCHEMBL7661239 0.86 KMT2A (0.56) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6814941 0.84 ALDH1A1 (0.60) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL7657979 0.83 MEN1 (0.70) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL7687308 0.82 SMN1; SMN2 (0.58) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6816557 0.82 MAPT (0.56) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6815989 0.81 MAPT (0.64) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6811901 0.81 MAPT (0.64) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6811376 0.80 ALDH1A1 (0.55) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6815466 0.80 MAPT (0.55) KMT2AMEN1NPSR1MAPTCYP1A2
SCHEMBL6814540 0.80 MAPT (0.55) KMT2AMEN1NPSR1MAPTCYP1A2

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-6407249-B1 COMPOUNDS CONTAINING FURAN RING STRUCTURE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed