SCHEMBL5319955

SCHEMBL5319955

O=C1CCCCC1(I)C(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
ALDH1A1 P00352 2/20 0.41

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
SCHEMBL3696556 0.81 DDB1 (0.49) DDB1CRBN
SCHEMBL2125064 0.81 DDB1 (0.54) DDB1CRBNALDH1A1
SCHEMBL28055381 0.80 DDB1 (0.64) DDB1CRBNALDH1A1
SCHEMBL28055405 0.80 DDB1 (0.64) DDB1CRBNALDH1A1
SCHEMBL14537683 0.80 DDB1 (0.50) DDB1CRBNALDH1A1
SCHEMBL28351712 0.76 DDB1 (0.47) DDB1CRBNALDH1A1
SCHEMBL28355472 0.76 DDB1 (0.47) DDB1CRBNALDH1A1
SCHEMBL7228727 0.74 DDB1 (0.52) DDB1CRBNALDH1A1
SCHEMBL4962412 0.74 DDB1 (0.56) DDB1CRBNALDH1A1
SCHEMBL23847125 0.73 DDB1 (0.51) DDB1CRBNALDH1A1

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-2007103719-A2 MODULATORS OF 11-β HYDROXYL STEROID DEHYDROGENASE TYPE 1, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2007-09-13 WO disclosed