SCHEMBL7590802

SCHEMBL7590802

C[C@H](N)C(=O)Oc1ccc(NC(=O)OCc2ccccc2Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
RAB9A P51151 3/20 0.51
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
XIAP P98170 1/20 0.48
PTGDR2 Q9Y5Y4 2/20 0.48
PKM P14618 1/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
SCN9A Q15858 2/20 0.44
SCN5A Q14524 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
SCHEMBL7585707 0.83 TP53 (0.62) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL7590807 0.79 RAB9A (0.53) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL7590812 0.79 RAB9A (0.53) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL157299 0.78 RAB9A (0.62) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL95063 0.77 RAB9A (0.56) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL9123298 0.71 MGLL (0.51) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL14031246 0.71 CASP3 (0.56) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL12617736 0.70 NPC1 (0.60) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL237660 0.70 GLA (0.47) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL23493150 0.70 ELANE (0.55) MAPTRAB9AMEN1KMT2AALDH1A1

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-2002100885-A2 A PENTA- OR TETRAPEPTIDE BINDING TO SOMATOSTATIN RECEPTORS AND THE USE OF THE SAME NOVASPIN BIOTECH GMBH (DE) 2002-12-19 WO disclosed