SCHEMBL311660

SCHEMBL311660

CCC(C)c1c(C)ccc(C=O)c1O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.38
ERN1 O75460 4/20 0.36
TSHR P16473 3/20 0.34
TLR2 O60603 1/20 0.34
TLR1 Q15399 1/20 0.34
TLR6 Q9Y2C9 1/20 0.34
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ALB P02768 2/20 0.32
HDAC4 P56524 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL311765 0.82 TYR (0.46) TYRERN1TSHRTLR2TLR1
SCHEMBL8850683 0.78 CYP2C9 (0.45) TYRERN1TSHRTLR2TLR1
SCHEMBL8850989 0.78 CYP2C9 (0.45) TYRERN1TSHRTLR2TLR1
SCHEMBL8850689 0.78 CYP2C9 (0.45) TYRERN1TSHRTLR2TLR1
SCHEMBL13656361 0.75 ALB (0.32) TSHRALDH1A1KDM4EMEN1POLB
SCHEMBL7262436 0.75 TSHR (0.47) TSHRALDH1A1HDAC4HDAC2HDAC8
SCHEMBL8851443 0.74 VKORC1 (0.41) TYRERN1TSHRTLR2TLR1
SCHEMBL8851451 0.74 VKORC1 (0.41) TYRERN1TSHRTLR2TLR1
SCHEMBL4313398 0.74 GABRA1 (0.42) TSHRALDH1A1PKM
SCHEMBL452160 0.72 ERN1 (0.48) TYRERN1TSHRTLR2TLR1

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