SCHEMBL812049

SCHEMBL812049

O=c1n(C(O)c2ccccc2)c(=O)n(C(O)c2ccccc2)c(=O)n1C(O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.44
MAPK1 P28482 1/20 0.44
SRC P12931 2/20 0.41
CYP2D6 P10635 1/20 0.41
SLC6A2 P23975 2/20 0.41
CES2 O00748 2/20 0.40
CES1 P23141 2/20 0.40
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL1718164 0.77 DAO (0.41) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL16719672 0.74 KDM4E (0.43) LMNAMAPK1CYP2D6TSHRALDH1A1
SCHEMBL6047023 0.71 CES2 (0.43) LMNAMAPK1SRCCYP2D6SLC6A2
SCHEMBL15581083 0.71 ALDH1A1 (0.47) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL8026290 0.68 TSHR (0.41) LMNAMAPK1CYP2D6TSHR
SCHEMBL1038340 0.66
Diphenylmethanol SCHEMBL10868602 0.64 SMN1; SMN2 (0.61) LMNAMAPK1SRCCYP2D6TSHR
Diphenylmethanol SCHEMBL41571 0.64 SMN1; SMN2 (0.61) LMNAMAPK1SRCCYP2D6TSHR
SCHEMBL2889714 0.64 LMNA (0.62) LMNAMAPK1CYP2D6SLC6A2TSHR
SCHEMBL108052 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105385124-B Carbon fiber reinforced polylactic acid 3D printing material and preparation method thereof 浙江工业大学 2017-04-26 CN disclosed
EP-2406306-B1 FLAME RETARDED POLYOLEFIN COMPOSITION ICL IP AMERICA INC (US) 2013-10-30 EP disclosed
US-20120121877-A1 FLAME RETARDED POLYOLEFIN COMPOSITION ICL-IP AMERICA INC. 2012-05-17 US disclosed
EP-2406306-A1 FLAME RETARDED POLYOLEFIN COMPOSITION ICL-IP America Inc. (US) 2012-01-18 EP disclosed
WO-2010104689-A1 FLAME RETARDED POLYOLEFIN COMPOSITION ICL-IP AMERICA INC. (US) 2010-09-16 WO disclosed
US-5238979-A Bisphenol phosphites and a phenol ASAHI DENKA KOGYO K.K. (JP) 1993-08-24 US disclosed
US-4532278-A Extruded polyolefin fiber containing aromatic bromine compound, dialkylsubstituted/hydroxybenzyl/isocyanurate HANCOCK HENRY 1985-07-30 US disclosed
US-4532278-A Extruded polyolefin fiber containing aromatic bromine compound, dialkylsubstituted/hydroxybenzyl/isocyanurate HANCOCK HENRY 1985-07-30 US disclosed