SCHEMBL1358032

SCHEMBL1358032

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(=O)c1ccccc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ LMNA P02545 2/20 0.58
▸ KMT2A Q03164 2/20 0.58
▸ MPO P05164 1/20 0.58
▸ TSHR P16473 1/20 0.58
▸ BLM P54132 1/20 0.58
▸ PMP22 Q01453 1/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ TACR1 P25103 2/20 0.54
▸ CDK4 P11802 1/20 0.49
▸ CCND1 P24385 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HTR2A P28223 2/20 0.47
▸ ADRB1 P08588 1/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ HTR1D P28221 1/20 0.47

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
SCHEMBL28649897 0.88 KMT2A (0.61) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL289044 0.85 MAPT (0.74) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL475351 0.85 MAPT (0.74) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL21059260 0.83 MAPT (0.70) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL27744048 0.83 KMT2A (0.54) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL1640627 0.82 MAPT (0.68) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL17503190 0.82 MAPT (0.72) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL626831 0.81 MAPT (0.72) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL28780405 0.81 MAPT (0.72) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL23723484 0.81 MAPT (0.76) MAPTKDM4EMEN1LMNAKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927695-B2 Protein-based assays for screening of the IgE-receptor interaction THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2015-01-06 — — US disclosed
US-20110281365-A1 PROTEIN-BASED ASSAYS FOR SCREENING OF THE IGE-RECEPTOR INTERACTION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2011-11-17 — — US disclosed
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