SCHEMBL7561519

SCHEMBL7561519

Nc1nc(N)nc(N)n1.OCOCO

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.39
CYP1A2 P05177 1/20 0.39
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL9014232 0.84 LMNA (0.36) CASP1CYP1A2LMNASMN1; SMN2NPC1
SCHEMBL10800782 0.79 CASP1 (0.47) CASP1CYP1A2LMNASMN1; SMN2NPC1
SCHEMBL736034 0.79 LMNA (0.40) CASP1CYP1A2LMNASMN1; SMN2NPC1
SCHEMBL10908182 0.79 LMNA (0.40) CASP1CYP1A2LMNASMN1; SMN2NPC1
SCHEMBL28045067 0.78 CYP1A2 (0.33) CASP1CYP1A2LMNA
SCHEMBL1011368 0.78 CDK1 (0.37) CASP1CYP1A2LMNA
SCHEMBL9770779 0.78 CDK1 (0.37) CASP1CYP1A2LMNA
Di(Hydroxyethyl)Ether SCHEMBL9417112 0.77 TSHR (0.56) CASP1CYP1A2LMNA
SCHEMBL8578645 0.77 CA1 (0.35) SMN1; SMN2NPC1RAB9A
Ethylene Glycol SCHEMBL8570947 0.76 CASP1 (0.45) CASP1CYP1A2LMNASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105980427-B Finishing agent with blocked polyisocyanates RUDOLF GMBH (DE) 2019-07-16 CN disclosed
CN-109476819-A Preparation as hydrophobing agent 鲁道夫有限公司 2019-03-15 CN disclosed
CN-105980427-A Finishing agent with blocked polyisocyanates 鲁道夫有限公司 2016-09-28 CN disclosed
CN-103254539-B A kind of high-intensity high-tenacity protein molecule engram hybrid gel film and preparation method thereof TIANJIN POLYTECHNIC UNIVERSITY (CN) 2015-09-16 CN disclosed
CN-103191657-B Hybridized gel film for filtration of organic solvent and preparation method thereof UNIV TIANJIN POLYTECHNIC 2015-04-22 CN disclosed
CN-103254539-A High-strength high-tenacity protein molecule imprinting hybrid gel film and preparation method thereof UNIV TIANJIN POLYTECHNIC 2013-08-21 CN disclosed
CN-103191657-A Hybridized gel film for filtration of organic solvent and preparation method thereof UNIV TIANJIN POLYTECHNIC 2013-07-10 CN disclosed
CN-103170250-A Hybridization hydrogel flat membrane for water filtration and preparation method thereof UNIV TIANJIN POLYTECHNIC 2013-06-26 CN disclosed
US-20020120055-A1 Adhesive mixtures of hydroxyl-or carboxyl-group-containing solution rubbers BAYER AKTIENGESELLSCHAFT (DE) 2002-08-29 US disclosed
US-5238781-A PHOTOSENSITIVE COMPOSITIONS BASED ON POLYPHENOLS AND ACETALS CIBA-GEIGY CORPORATION (US) 1993-08-24 US disclosed
US-4682983-A Transfer sheet for the thermal dry impression of cellulose fibers SICPA HOLDING S.A. (CH) 1987-07-28 US disclosed
US-4260515-A ADDITION POLYMERS CONTAINING ACETYLACETATE GROUPS CROSSLINKED WITHN-METHYLOLMELAMINES OR ETHERS THEREOF BASF AKTIENGESELLSCHAFT (DE) 1981-04-07 US disclosed