SCHEMBL28801464

SCHEMBL28801464

COCOCc1ccc(Cl)nc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
POLB P06746 2/20 0.49
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 2/20 0.43
PLK1 P53350 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL1145938 0.85 ALDH1A1 (0.54) ALDH1A1NPC1RAB9APOLBMAPT
SCHEMBL27527331 0.85 ALDH1A1 (0.49) ALDH1A1NPC1RAB9APOLBMAPT
SCHEMBL3405892 0.84 ALDH1A1 (0.48) ALDH1A1NPC1RAB9APOLBMAPT
SCHEMBL1727075 0.81 ALDH1A1 (0.48) ALDH1A1NPC1RAB9APOLBMAPT
SCHEMBL7841404 0.80 PDE1B (0.39) POLBMEN1KMT2ALMNAGAA
SCHEMBL2644223 0.79 GABRP (0.43) KDM4E
SCHEMBL12509022 0.77 ALDH1A1 (0.49) ALDH1A1NPC1RAB9APOLBMAPT
SCHEMBL21348435 0.75 PDE2A (0.37)
SCHEMBL31508111 0.74 ALDH1A1 (0.45) ALDH1A1NPC1RAB9APOLBMAPT
SCHEMBL795938 0.74 ALDH1A1 (0.46) ALDH1A1NPC1RAB9APOLBMAPT

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
CN-102762206-A Homogeneous suspension of immunopotentiating compounds and uses thereof NOVARTIS AG 2012-10-31 CN disclosed