SCHEMBL4726534

SCHEMBL4726534

O=C(O)c1ccc(CCc2ccccc2OCc2ccc(F)cc2)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.52
PTGER4 P35408 1/20 0.52
PTGER3 P43115 1/20 0.52
PTGER2 P43116 1/20 0.52
HTR1A P08908 1/20 0.51
DRD2 P14416 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
POLB P06746 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TRPV6 Q9H1D0 1/20 0.48
MAPT P10636 3/20 0.48
SLC1A5 Q15758 1/20 0.47
ALDH1A1 P00352 1/20 0.47
PKM P14618 1/20 0.47
MGLL Q99685 1/20 0.46

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
SCHEMBL4777687 0.90 KMT2A (0.49) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL4252417 0.80 ALDH1A1 (0.59) L3MBTL1POLBTDP1SENP8SENP7
SCHEMBL4725186 0.78 NR4A2 (0.60) L3MBTL1TDP1MEN1KMT2AMAPT
SCHEMBL27555763 0.78 TDP1 (0.56) L3MBTL1POLBTDP1MEN1KMT2A
SCHEMBL14008082 0.76 PTGER1 (0.69) PTGER1POLBALDH1A1LMNANPC1
SCHEMBL5092502 0.76 CFD (0.58) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL4725923 0.74 NR4A2 (0.57) L3MBTL1TDP1MEN1KMT2AMAPT
SCHEMBL15726355 0.73 PTGER1 (0.84) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL8406722 0.73 PTGER1 (0.84) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL3229701 0.73 POLB (0.75) L3MBTL1POLBTDP1MEN1KMT2A

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
WO-2008016278-A1 FURAN-2-CARBOXYLIC ACID DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-02-07 WO claimed
WO-2008016278-A1 FURAN-2-CARBOXYLIC ACID DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-02-07 WO disclosed