SCHEMBL311765

SCHEMBL311765

Cc1ccc(C=O)c(O)c1C(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.46
ALB P02768 2/20 0.41
ERN1 O75460 5/20 0.41
AKR1B1 P15121 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MCL1 Q07820 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
NPC1 O15118 2/20 0.41
USP2 O75604 2/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 2/20 0.41
HPGD P15428 2/20 0.41
ALOX12 P18054 2/20 0.41
MAPK1 P28482 2/20 0.41
BLM P54132 2/20 0.41
KMT2A Q03164 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
SCHEMBL16096543 0.82 TYR (0.52) TYRALBERN1TLR2TLR1
SCHEMBL311660 0.82 TYR (0.38) TYRALBERN1ALDH1A1KDM4E
SCHEMBL5697225 0.81 TYR (0.46) TYRALBERN1AKR1B1ALDH1A1
SCHEMBL8851443 0.80 VKORC1 (0.41) TYRERN1ALDH1A1MCL1KDM4E
SCHEMBL8851451 0.80 VKORC1 (0.41) TYRERN1ALDH1A1MCL1KDM4E
SCHEMBL311545 0.79 TYR (0.44) TYRALBERN1TDP1TLR2
SCHEMBL452160 0.77 ERN1 (0.48) TYRERN1ALDH1A1MEN1LMNA
SCHEMBL3065272 0.75 ERN1 (0.46) TYRERN1ALDH1A1KDM4EMEN1
SCHEMBL8850689 0.74 CYP2C9 (0.45) TYRALBERN1ALDH1A1KDM4E
SCHEMBL8850989 0.74 CYP2C9 (0.45) TYRALBERN1ALDH1A1KDM4E

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-8093349-B2 Terminally modified polybranched polyimide, metal-plated terminally modified polybranched polyimide, and method for producing the same UBE INDUSTRIES, LTD. (JP) 2012-01-10 US disclosed
US-20100009206-A1 TERMINALLY MODIFIED POLYBRANCHED POLYIMIDE, METAL-PLATED TERMINALLY MODIFIED POLYBRANCHED POLYIMIDE, AND METHOD FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2010-01-14 US disclosed