SCHEMBL9296185

SCHEMBL9296185

CN(CC(=O)O)C(=O)c1c2oc3ccccc3nc-2ccc1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.37
RAB9A P51151 5/20 0.37
KMT2A Q03164 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 5/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 3/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALPL P05186 1/20 0.36
POLB P06746 1/20 0.36
ALPI P09923 1/20 0.36
ALPG P10696 1/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 3/20 0.36
NR4A2 P43354 1/20 0.36

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
SCHEMBL10351910 0.82 RAB9A (0.34) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9295725 0.82 KMT2A (0.32) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL1513840 0.81 MEN1 (0.43) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
Phosphoric Acid SCHEMBL1513833 0.77 RAB9A (0.42) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL25280719 0.71 MAPT (0.47) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9327776 0.71 MAPT (0.51) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL31314578 0.70 KDM4E (0.54) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9819945 0.70 MEN1 (0.41) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL10352708 0.70 ELANE (0.35) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9051488 0.70 LMNA (0.49) RAB9ASMN1; SMN2ALDH1A1MAPTGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4954630-A COLORIMETRIC OR FLUORESCENT ANALYSIS BOEHRINGER MANNHEIM GMBH (DE) 1990-09-04 US claimed
US-5304645-A Colored or fluorescent labels BOEHRINGER MANNHEIM GMBH (DE) 1994-04-19 US disclosed