SCHEMBL7683185

SCHEMBL7683185

CCCNC(=O)c1nc(C)ccc1C(=O)Nc1cccc(Br)c1C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 5/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 2/20 0.40
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALOX12 P18054 1/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 3/20 0.37
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PTGES O14684 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 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
SCHEMBL7677603 0.90 ALDH1A1 (0.42) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7679306 0.88 ALDH1A1 (0.40) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7679294 0.84 ALDH1A1 (0.34) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7675233 0.83 ALDH1A1 (0.34) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7686045 0.82 HPGD (0.44) ALDH1A1KDM4EMEN1KMT2AHPGD
SCHEMBL7684169 0.79 ALDH1A1 (0.37) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7681327 0.79 EPHX1 (0.58) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7682616 0.78 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDSMN1; SMN2TP53
SCHEMBL7678756 0.78 HTT (0.38) ALDH1A1KDM4EHPGDSMN1; SMN2TP53
SCHEMBL7683202 0.77 ALDH1A1 (0.57) ALDH1A1KDM4EKMT2AGAAHPGD

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