SCHEMBL1122848

SCHEMBL1122848

COC(=O)CN(C(=O)c1cccc(OCCSc2cccs2)c1)c1cccs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
TP53 P04637 1/20 0.46
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
ADRB2 P07550 1/20 0.39
NPC1 O15118 2/20 0.37
HPGD P15428 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 2/20 0.37
MAPT P10636 3/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
POLB P06746 2/20 0.35

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
SCHEMBL1122939 0.81 KMT2A (0.45) LMNATP53KMT2AMEN1ADRB2
SCHEMBL1122756 0.78 KMT2A (0.55) KMT2AMEN1ADRB2NPC1RAB9A
SCHEMBL5720725 0.77 KMT2A (0.42) LMNATP53KMT2AMEN1ADRB2
SCHEMBL1122685 0.72 F10 (0.38) LMNATP53KMT2AMEN1TSHR
SCHEMBL1123197 0.72 MEN1 (0.43) KMT2AMEN1ADRB2NPC1HPGD
SCHEMBL6703333 0.67 KMT2A (0.53) TP53KMT2AMEN1NPC1HPGD
SCHEMBL9402627 0.65 SMPD1 (0.62) LMNATP53KMT2ATSHRSMPD1
SCHEMBL9402734 0.65 SMPD1 (0.62) LMNATP53KMT2ATSHRSMPD1
SCHEMBL9402732 0.65 SMPD1 (0.62) LMNATP53KMT2ATSHRSMPD1
SCHEMBL2452841 0.65 HSD17B2 (0.54) LMNATP53NPC1HPGDRAB9A

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
EP-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 EP disclosed