SCHEMBL6180923

SCHEMBL6180923

O=C1CCC([C@@H]2NCc3ccccc32)C(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 14/20 0.46
DDB1 Q16531 11/20 0.46
CYP1A2 P05177 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
CHRM2 P08172 1/20 0.40
OPRM1 P35372 1/20 0.40
IKZF3 Q9UKT9 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 2/20 0.38
CYP2D6 P10635 2/20 0.38
DRD1 P21728 2/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38

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
SCHEMBL27479960 1.00 CRBN (0.46) CRBNDDB1CYP1A2ALDH1A1TSHR
SCHEMBL16924509 0.83 CRBN (0.43) CRBNDDB1CYP1A2ALDH1A1TSHR
SCHEMBL8058860 0.81 CRBN (0.48) CRBNDDB1IKZF3
SCHEMBL31292137 0.78 CRBN (0.46) CRBNDDB1IKZF3
SCHEMBL2010576 0.78 CRBN (0.48) CRBNDDB1IKZF3
SCHEMBL26192104 0.78 PRCP (0.46) CYP1A2ALDH1A1TSHRTP53CYP2D6
SCHEMBL1897413 0.74 CRBN (0.45) CRBNDDB1ALDH1A1IKZF3TDP1
SCHEMBL31243223 0.73 CRBN (0.47) CRBNDDB1CYP1A2ALDH1A1TSHR
SCHEMBL15609322 0.71 SRD5A1 (0.46)
SCHEMBL27360801 0.70 PRCP (0.56) CYP1A2ALDH1A1TSHRTP53CYP2D6

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
EP-1064277-B1 2-(2,6-DIOXOPIPERIDIN-3-YL)ISOINDOLINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF INFLAMMATORY CYTOKINES CELGENE CORP (US) 2005-06-15 EP claimed