SCHEMBL4274064

SCHEMBL4274064

NC(=O)[C](C(N)=O)c1ccc(=O)[nH]c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 3/20 0.40
EPHX2 P34913 3/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.39
TRPV6 Q9H1D0 1/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL2366245 0.83 POLB (0.44) POLBL3MBTL1ALDH1A1KMT2AEPHX2
Hydrochloric Acid SCHEMBL30612668 0.81 L3MBTL1 (0.46) POLBL3MBTL1ALDH1A1KMT2AEPHX2
SCHEMBL20003160 0.74 KMT2A (0.45) POLBL3MBTL1ALDH1A1KMT2AEPHX2
SCHEMBL4004484 0.74 KMT2A (0.45) POLBL3MBTL1ALDH1A1KMT2AEPHX2
SCHEMBL657937 0.74 POLB (0.47) POLBL3MBTL1ALDH1A1KMT2AEPHX2
SCHEMBL28192657 0.73 L3MBTL1 (0.55) L3MBTL1ALDH1A1KMT2AEPHX2MEN1
SCHEMBL15505019 0.73 KDM1A (0.39) POLBL3MBTL1ALDH1A1KMT2AEPHX2
SCHEMBL4399650 0.73 KDM1A (0.39) POLBL3MBTL1ALDH1A1KMT2AEPHX2
Lithium Ion SCHEMBL29771299 0.72 POLB (0.42) POLBL3MBTL1ALDH1A1KMT2AEPHX2
SCHEMBL9670998 0.71 POLB (0.45) POLBL3MBTL1ALDH1A1KMT2AEPHX2

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-2009134666-A1 INDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-05 WO disclosed