SCHEMBL9201481

SCHEMBL9201481

CCOC(=O)N1CC2C(O)CCN(Cc3ccccc3)C2C1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GBA1 P04062 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
CHRM1 P11229 2/20 0.44
BRD4 O60885 1/20 0.44
TSHR P16473 2/20 0.43
GAA P10253 1/20 0.43
CYP2C19 P33261 1/20 0.43
ATM Q13315 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHRM5 P08912 1/20 0.42

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
SCHEMBL6356905 0.85 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AL3MBTL1CHRM1
SCHEMBL9343911 0.82 MAPT (0.48) ALDH1A1MEN1KMT2AL3MBTL1CHRM1
SCHEMBL30608221 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1ATM
SCHEMBL26386510 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1ATM
SCHEMBL26386513 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1ATM
SCHEMBL24104493 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1ATM
SCHEMBL24104500 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1ATM
SCHEMBL9344787 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1ATM
SCHEMBL9596103 0.76 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL2847210 0.74 L3MBTL1 (0.51) ALDH1A1MEN1KMT2AL3MBTL1TSHR

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
EP-0650487-A1 NOVEL DIAZABICYCLOALKENES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-05-03 EP disclosed
WO-1994002479-A1 NOVEL DIAZABICYCLOALKENES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1994-02-03 WO disclosed