SCHEMBL8275151

SCHEMBL8275151

COBN1CCCC1c1cccc(C(=O)N2CCN(C)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
ALDH1A1 P00352 3/20 0.43
TSHR P16473 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL3 Q96JM7 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ERN1 O75460 1/20 0.41
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ROCK2 O75116 1/20 0.40
EPHX2 P34913 1/20 0.39

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
SCHEMBL8275148 0.84 KMO (0.48) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL8275150 0.83 ROCK2 (0.48) GAAALDH1A1TSHRKDM4EHPGD
SCHEMBL8219836 0.78 GAA (0.46) GAAALDH1A1TSHRKDM4EHPGD
SCHEMBL14494457 0.77 RIPK1 (0.47) GAATSHRHPGDMEN1KMT2A
SCHEMBL8414743 0.76 KMO (0.56) GAAALDH1A1TSHRKDM4ELMNA
SCHEMBL8275132 0.76 MC4R (0.43)
SCHEMBL8275146 0.74 ALDH1A1 (0.46) ALDH1A1TSHRKMT2AROCK2
SCHEMBL10723960 0.72 HPGD (0.68) GAAALDH1A1TSHRKDM4ELMNA
SCHEMBL8220141 0.71 MBTD1 (0.49) GAAALDH1A1TSHRHPGDMEN1
SCHEMBL13504020 0.69 ALDH1A1 (0.74) GAAALDH1A1HPGDMEN1KMT2A

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-2005121130-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2005-12-22 WO disclosed