SCHEMBL7685879

SCHEMBL7685879

COC(=O)c1c(Br)ccc(C)c1NC(=O)c1ccc(C)nc1C(=O)NC(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
KMT2A Q03164 2/20 0.34
F2 P00734 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
NPC1 O15118 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
RAB9A P51151 2/20 0.33
MAPK1 P28482 1/20 0.33
PTGER4 P35408 2/20 0.32
LMNA P02545 1/20 0.32
GRM5 P41594 1/20 0.32
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL7684146 0.91 MAPT (0.35) MAPTKMT2AF2PDE4APDE4B
SCHEMBL7679448 0.89 SMN1; SMN2 (0.33) MAPTKMT2AF2PDE4APDE4B
SCHEMBL7685639 0.88 ALDH1A1 (0.36) MAPTKMT2AF2PDE4APDE4B
SCHEMBL7684085 0.87 PDE4D (0.40) MAPTKMT2AF2PDE4APDE4B
SCHEMBL7679294 0.85 ALDH1A1 (0.34) MAPTKMT2AF2PDE4APDE4B
SCHEMBL7678830 0.83 PDE4A (0.33) MAPTKMT2APDE4APDE4BPDE4C
SCHEMBL7682616 0.83 ALDH1A1 (0.39) ALDH1A1HPGDHSD17B10L3MBTL1LMNA
SCHEMBL7675254 0.82 POLB (0.39) KMT2APTGER4POLB
SCHEMBL7686030 0.82 PTGS2 (0.35) MAPTKMT2AF2PDE4APDE4B
SCHEMBL7684669 0.82 MAPT (0.34) MAPTKMT2AF2PDE4APDE4B

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-6472349-B1 Pyridine-2,3-dicarboxylic acid diamides BASF AKTIENGESELLSCHAFT (DE) 2002-10-29 US claimed