SCHEMBL6825516

SCHEMBL6825516

COc1ccc(Cl)cc1NC(=O)NCC(C)(C)CC(=O)N(CCC(C)C)CC(=O)NO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 3/20 0.47
ALDH1A1 P00352 7/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 2/20 0.43
GAA P10253 5/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 1/20 0.41
CCR3 P51677 1/20 0.41
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL6822427 0.90 TRPV1 (0.43) KMT2AMEN1MAPTNPSR1GAA
SCHEMBL6822346 0.88 RAB9A (0.39) KMT2AMAPTALDH1A1LMNAL3MBTL1
SCHEMBL6822424 0.88 ANPEP (0.45) KMT2AMEN1MAPTLMNA
SCHEMBL6825420 0.87 LMNA (0.40) KMT2AMEN1MAPTALDH1A1NPSR1
SCHEMBL6825496 0.86 ALDH1A1 (0.49) KMT2AMEN1MAPTALDH1A1CYP1A2
SCHEMBL6826030 0.84 ALDH1A1 (0.48) KMT2AMEN1MAPTALDH1A1CYP1A2
SCHEMBL6825402 0.83 ALDH1A1 (0.49) KMT2AMEN1MAPTALDH1A1CYP1A2
SCHEMBL6822142 0.83 KMT2A (0.49) KMT2AMEN1MAPTALDH1A1CYP1A2
SCHEMBL6825506 0.81 KMT2A (0.56) KMT2AMEN1MAPTALDH1A1CYP1A2
SCHEMBL6825882 0.79 CASR (0.45) KMT2AMEN1MAPTALDH1A1LMNA

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
WO-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed