SCHEMBL459863

SCHEMBL459863

O=C(OCc1ccco1)C(=O)c1ccco1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
CES2 O00748 1/20 0.55
CES1 P23141 1/20 0.55
PTPN1 P18031 1/20 0.50
POLB P06746 6/20 0.49
TSHR P16473 2/20 0.49
TDP1 Q9NUW8 3/20 0.48
MAPK1 P28482 2/20 0.48
HTT P42858 2/20 0.47
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.44
SLC1A3 P43003 1/20 0.43
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
GAA P10253 2/20 0.41
USP2 O75604 1/20 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
SCHEMBL7636627 0.85 CES2 (0.57) ALDH1A1CES2CES1PTPN1POLB
SCHEMBL179961 0.83 ALDH1A1 (0.64) ALDH1A1POLBTSHRTDP1MAPK1
SCHEMBL11761636 0.81 ALDH1A1 (0.66) ALDH1A1PTPN1POLBTSHRTDP1
SCHEMBL986419 0.79 CES2 (0.59) ALDH1A1CES2CES1PTPN1POLB
SCHEMBL14991432 0.78 ALDH1A1 (0.72) ALDH1A1POLBTSHRTDP1MAPK1
SCHEMBL29056404 0.78 ALDH1A1 (0.62) ALDH1A1POLBTSHRTDP1MAPK1
SCHEMBL6443452 0.77 ALDH1A1 (0.70) ALDH1A1POLBTSHRTDP1MAPK1
SCHEMBL6443447 0.77 ALDH1A1 (0.70) ALDH1A1POLBTSHRTDP1MAPK1
SCHEMBL11583754 0.77 ALDH1A1 (0.70) ALDH1A1POLBTSHRTDP1MAPK1
SCHEMBL7710817 0.77 KMT2A (0.57) ALDH1A1CES2CES1PTPN1POLB

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376503-B2 Cellulose-based composite materials YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2016-06-28 US claimed
CN-103370190-B cellulose-based composite material YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2016-05-04 CN claimed
CN-103370190-A Cellulose-based composite material YISSUM RES DEV CO 2013-10-23 CN claimed
EP-2613935-A1 CELLULOSE-BASED COMPOSITE MATERIALS Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2013-07-17 EP claimed
US-20130171439-A1 CELLULOSE-BASED COMPOSITE MATERIALS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2013-07-04 US claimed
WO-2012032514-A1 CELLULOSE-BASED COMPOSITE MATERIALS YISSUM RESEARCH AND DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2012-03-15 WO claimed
US-4439568-A FURAN RESIN BINDER DILUTED WITH 5-HYDROXYMETHYL FURFURAL THE QUAKER OATS COMPANY (US) 1984-03-27 US claimed
EP-2613935-B1 CELLULOSE-BASED COMPOSITE MATERIALS YISSUM RES DEV CO (IL) 2016-12-07 EP disclosed
US-9376503-B2 Cellulose-based composite materials YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2016-06-28 US disclosed
CN-103370190-A Cellulose-based composite material YISSUM RES DEV CO 2013-10-23 CN disclosed
EP-2613935-A1 CELLULOSE-BASED COMPOSITE MATERIALS Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2013-07-17 EP disclosed
US-20130171439-A1 CELLULOSE-BASED COMPOSITE MATERIALS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2013-07-04 US disclosed
WO-2012032514-A1 CELLULOSE-BASED COMPOSITE MATERIALS YISSUM RESEARCH AND DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2012-03-15 WO disclosed
US-4474636-A FURAN RESINS, HYDROXYMETHYLFURFURAL QO CHEMICALS, INC. (US) 1984-10-02 US disclosed
US-4439568-A FURAN RESIN BINDER DILUTED WITH 5-HYDROXYMETHYL FURFURAL THE QUAKER OATS COMPANY (US) 1984-03-27 US disclosed