SCHEMBL20495997

SCHEMBL20495997

O=c1n(CCCCCCCCCC2CO2)c(=O)n(CCCCCCCCCC2CO2)c(=O)n1CCCCCCCCCC1CO1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
HBB P68871 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 2/20 0.48
CYP1A2 P05177 2/20 0.34
EPHX1 P07099 1/20 0.32
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
GRM2 Q14416 3/20 0.30
DHFR P00374 1/20 0.30

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
SCHEMBL20495995 1.00 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL10329459 1.00 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL8577891 0.98 TP53 (0.52) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL24855261 0.96 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL17153973 0.92 TP53 (0.47) TP53HBBSMN1; SMN2ALDH1A1
SCHEMBL21991221 0.91 TP53 (0.54) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL8580238 0.91 TP53 (0.54) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL21026336 0.91 TP53 (0.54) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL12047489 0.90 TP53 (0.45) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL12060390 0.90 TP53 (0.45) TP53HBBSMN1; SMN2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108350146-B Epoxy resin composition containing long-chain alkylene group 日产化学工业株式会社 2021-03-16 CN disclosed
EP-3375804-B1 LONG-CHAIN ALKYLENE GROUP-CONTAINING EPOXY RESIN COMPOSITION NISSAN CHEMICAL CORP (JP) 2020-10-14 EP disclosed
US-10669369-B2 Long-chain alkylene group-containing epoxy resin composition NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2020-06-02 US disclosed
US-20180340040-A1 LONG-CHAIN ALKYLENE GROUP-CONTAINING EPOXY RESIN COMPOSITION NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-11-29 US disclosed
EP-3375804-A1 LONG-CHAIN ALKYLENE GROUP-CONTAINING EPOXY RESIN COMPOSITION Nissan Chemical Corporation (JP) 2018-09-19 EP disclosed