SCHEMBL8459387

SCHEMBL8459387

C=C(CC(=O)O)C(=O)OCC(O)CCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
GPR84 Q9NQS5 4/20 0.33
EGLN1 Q9GZT9 2/20 0.33
KDM4E B2RXH2 1/20 0.32
DUSP3 P51452 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
FFAR1 O14842 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL10415753 0.88 GPR84 (0.50) TSHRGPR84KDM4EDUSP3MEN1
SCHEMBL8459383 0.87 KDM4E (0.38) TSHRKDM4EDUSP3MEN1KMT2A
SCHEMBL8462676 0.86 TSHR (0.36) TSHREGLN1KDM4EDUSP3MEN1
SCHEMBL9773627 0.82 ALDH1A1 (0.40) TSHRALOX15HSD17B10CHRM1AKR1A1
Dodecane SCHEMBL21051235 0.81 KDM4E (0.55) TSHRGPR84KDM4EDUSP3MEN1
SCHEMBL11076109 0.81 TSHR (0.35) TSHRALOX15HSD17B10
SCHEMBL2722972 0.81 KDM4E (0.38) TSHRKDM4EDUSP3MEN1KMT2A
SCHEMBL964801 0.79 TSHR (0.57) TSHRKDM4EDUSP3MEN1KMT2A
SCHEMBL2809912 0.79 TSHR (0.42) TSHRALOX15HSD17B10ALDH1A1CYP2D6
SCHEMBL10396151 0.78 ALOX15 (0.38) TSHRALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317297-A1 METHODS AND COMPOSITION OF A DENTAL MODEL FOR THE MANUFACTURE OF ORTHODONTIC APPLIANCES WITHOUT THE USE OF SEPARATOR STRUCTO PTE LTD (SG) 2021-10-14 US disclosed
EP-3820398-A1 METHODS AND COMPOSITION OF A DENTAL MODEL FOR THE MANUFACTURE OF ORTHODONTIC APPLIANCES WITHOUT THE USE OF SEPARATOR Structo Pte. Ltd. (SG) 2021-05-19 EP disclosed
US-20130261254-A1 REACTIVE DILUENTS, METHODS OF REACTING, AND THERMOSET POLYMERS DERIVED THEREFROM SEGETIS, INC. (US) 2013-10-03 US disclosed
WO-2013148933-A1 REACTIVE DILUENTS, METHODS OF REACTING, AND THERMOSET POLYMERS DERIVED THEREFROM SEGETIS, INC. (US) 2013-10-03 WO disclosed
EP-0607900-B1 Resin composition for artificial marble, bulk molding compound and sheet molding compound using the same, and process for preparing artificial marble using the same HITACHI CHEMICAL CO LTD (JP) 1999-04-14 EP disclosed
US-5356953-A Resin composition for artificial marble, bulk molding compound and sheet molding compound using the same, and process for preparing artificial marble using the same HITACHI CHEMICAL COMPANY LIMITED (JP) 1994-10-18 US disclosed
EP-0607900-A2 Resin composition for artificial marble, bulk molding compound and sheet molding compound using the same, and process for preparing artificial marble using the same Hitachi Chemical Co., Ltd. (JP) 1994-07-27 EP disclosed
US-5009949-A Resin impregnated substrate HITACHI CHEMICAL COMPANY, LTD. (JP) 1991-04-23 US disclosed
EP-0293112-A2 Resin composition and electrical laminate obtained therefrom Hitachi Chemical Co., Ltd. (JP) 1988-11-30 EP disclosed