SCHEMBL359720

SCHEMBL359720

CCOC(=O)c1cn(-c2nc3ccc(OC)cc3s2)nc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.50
CA2 P00918 3/20 0.50
CA9 Q16790 3/20 0.50
CA1 P00915 2/20 0.50
SMN1; SMN2 Q16637 5/20 0.49
LMNA P02545 4/20 0.49
GAA P10253 2/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPT P10636 6/20 0.49
TSHR P16473 4/20 0.49
ALDH1A1 P00352 3/20 0.49
TP53 P04637 3/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2C9 P11712 1/20 0.49
KDM4E B2RXH2 2/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48

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
SCHEMBL371135 0.88 MAPT (0.42) CA12CA2CA9CA1SMN1; SMN2
SCHEMBL10340643 0.76 ALDH1A1 (0.55) CA12CA9SMN1; SMN2LMNAHPGD
SCHEMBL20028196 0.76 MAPT (0.55) SMN1; SMN2LMNAGAAHPGDMEN1
SCHEMBL22897266 0.76 SMN1; SMN2 (0.52) SMN1; SMN2LMNAGAAHPGDMEN1
SCHEMBL20554113 0.73 SMN1; SMN2 (0.52) SMN1; SMN2LMNAGAAHPGDMEN1
SCHEMBL360852 0.71 MAPT (0.58) CA12CA2CA9CA1SMN1; SMN2
SCHEMBL1509460 0.69 ALDH1A1 (0.51) CA12CA9SMN1; SMN2LMNAHPGD
SCHEMBL8357021 0.69 ALDH1A1 (0.61) CA12CA2CA9SMN1; SMN2LMNA
SCHEMBL369164 0.69 ALDH1A1 (0.48) CA12CA9SMN1; SMN2LMNAGAA
SCHEMBL2079861 0.68 NPSR1 (0.64) CA12CA9SMN1; SMN2HPGDPOLB

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-2012007510-A1 COMPOUNDS FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-19 WO disclosed