SCHEMBL8052162

SCHEMBL8052162

CCOC(=O)c1nc(C=O)[nH]c1SCc1ccc(OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
TARBP2 Q15633 2/20 0.43
MMP13 P45452 1/20 0.43
PDCD4 Q53EL6 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
MAPT P10636 5/20 0.41
POLB P06746 2/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 6/20 0.40
RAB9A P51151 6/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HTT P42858 2/20 0.40
TDP1 Q9NUW8 2/20 0.39
CCR6 P51684 1/20 0.39

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
SCHEMBL3840799 0.86 FFAR1 (0.46) LMNAMMP13SMN1; SMN2MAPTPOLB
SCHEMBL8043911 0.85 TARBP2 (0.46) LMNATARBP2MMP13PDCD4L3MBTL1
SCHEMBL8035014 0.82 TARBP2 (0.42) LMNATARBP2MMP13PDCD4L3MBTL1
SCHEMBL3841049 0.71 FFAR1 (0.49) LMNAMMP13SMN1; SMN2MAPTPOLB
SCHEMBL11876582 0.70 BRD4 (0.46) LMNATARBP2PDCD4L3MBTL1SMN1; SMN2
SCHEMBL18785380 0.70 LMNA (0.49) LMNATARBP2MMP13PDCD4L3MBTL1
SCHEMBL31629479 0.70 DAO (0.44) LMNATARBP2MMP13PDCD4L3MBTL1
SCHEMBL18785383 0.70 GABRA2 (0.49) LMNAMMP13SMN1; SMN2MAPTPOLB
SCHEMBL3839635 0.69 FFAR1 (0.45) LMNAMMP13SMN1; SMN2MAPTPOLB
SCHEMBL8435193 0.68 SMN1; SMN2 (0.42) LMNATARBP2MMP13PDCD4L3MBTL1

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-6143774-A DRUGS AS HYPOTENSIVE AGENTS HOECHST MARION ROUSSEL (FR) 2000-11-07 US disclosed