SCHEMBL8629720

SCHEMBL8629720

CCC(C)c1c(N)ccc(-c2ccc(N)cc2)c1C(C)CC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.36
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
USP2 O75604 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
CYP3A4 P08684 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TP53 P04637 1/20 0.33
PSMD14 O00487 1/20 0.33
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
GFER P55789 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
FYN P06241 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
Methane SCHEMBL28126707 0.98 GRIA4 (0.35) GRIA4ALDH1A1HPGDHSD17B10USP2
SCHEMBL107810 0.81 ALDH1A1 (0.45) ALDH1A1HPGDHSD17B10USP2GAA
SCHEMBL28057567 0.78 ALDH1A1 (0.39) GRIA4ALDH1A1HPGDHSD17B10GAA
Methane SCHEMBL28536983 0.77 CYP3A4 (0.37) GRIA4ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL5382005 0.75 ALDH1A1 (0.32) GRIA4ALDH1A1CYP3A4TDP1TP53
SCHEMBL8673670 0.71 TSHR (0.39) ALDH1A1HSD17B10CYP3A4TDP1MAPK1
SCHEMBL841650 0.71 USP2 (0.38) ALDH1A1HPGDHSD17B10USP2GAA
SCHEMBL23456214 0.70 GRIA4 (0.53) GRIA4ALDH1A1HPGDHSD17B10USP2
SCHEMBL3650390 0.69 ALDH1A1 (0.42) ALDH1A1HPGDHSD17B10USP2GAA
SCHEMBL28877103 0.68 TSHR (0.41) ALDH1A1HPGDHSD17B10USP2GAA

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
CN-113661190-B Laminated component comprising an anti-slip and waterproof outer layer and method for the production thereof 科思创有限公司 2023-08-01 CN disclosed
CN-114761464-A Method for producing polyoxyalkylene polyester polyols 科思创知识产权两合公司 2022-07-15 CN disclosed
CN-113661190-A Laminate part comprising an outer anti-slip and waterproof layer and method for the production thereof 科思创有限公司 2021-11-16 CN disclosed
WO-2021122401-A1 PROCESS FOR PREPARING POLYOXYALKYLENE POLYESTER POLYOLS COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2021-06-24 WO disclosed
WO-2020239525-A1 PROCESS FOR PRODUCING POLYOXYALKYLENE-POLYOL MIXTURES COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2020-12-03 WO disclosed
CN-110382230-A Composite component 巴斯夫欧洲公司 2019-10-25 CN disclosed
CN-101821151-B Roof module BAYER MATERIALSCIENCE AG 2013-04-10 CN disclosed
EP-0850258-A1 COMPOSITIONS OF POLYTETRAMETHYLENE ETHER GLYCOLS AND POLYOXY ALKYLENE POLYETHER POLYOLS HAVING A LOW DEGREE OF UNSATURATION BASF CORPORATION (US) 1998-07-01 EP disclosed
WO-1998001492-A1 COMPOSITIONS OF POLYTETRAMETHYLENE ETHER GLYCOLS AND POLYOXY ALKYLENE POLYETHER POLYOLS HAVING A LOW DEGREE OF UNSATURATION BASF CORPORATION (DE) 1998-01-15 WO disclosed