SCHEMBL4093121

SCHEMBL4093121

CC=C(C)C(=O)OC1CCC(=O)O1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
KMT2A Q03164 1/20 0.33
PTPN1 P18031 1/20 0.33
KDM4E B2RXH2 4/20 0.33
HPGD P15428 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
POLB P06746 1/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 1/20 0.33
NPC1 O15118 1/20 0.32
MITF O75030 1/20 0.32
RAB9A P51151 1/20 0.32
PAX8 Q06710 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GPR52 Q9Y2T5 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
SCHEMBL75437 0.83 CA1 (0.38) CA1CA9KMT2AKDM4EALDH1A1
SCHEMBL7747592 0.82 CA1 (0.43) CA1CA9KMT2APOLBPRKCA
SCHEMBL5304809 0.82 CA1 (0.43) CA1CA9KMT2APOLBPRKCA
SCHEMBL5170309 0.76 CA1 (0.40) CA1CA9LMNAPRKCACYP1A2
SCHEMBL5171201 0.76 CA1 (0.40) CA1CA9LMNAPRKCACYP1A2
SCHEMBL447330 0.76 CA1 (0.40) CA1CA9LMNAPRKCACYP1A2
SCHEMBL4093119 0.76 CA1 (0.35) CA1CA9PRKCACYP1A2
SCHEMBL9041353 0.74 CA1 (0.39) CA1CA9PRKCACYP1A2
SCHEMBL10626844 0.74 CA1 (0.39) CA1CA9LMNAPRKCACYP1A2
SCHEMBL14889302 0.74 CA1 (0.35) CA1CA9

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
US-6313321-B1 Process for preparing β-hydroxy-γ-butyrolactones and β-(meth)acryloyloxy-γ-butrolactones MITSUBISHI RAYON CO., LTD. (JP) 2001-11-06 US claimed
WO-2024018725-A1 SEQUENCE ANALYZING METHOD, SEQUENCE ANALYZING DEVICE, POLYMERIZATION CONDITION PROPOSING DEVICE, AND AUTOMATIC SYNTHESIZING DEVICE 国立研究開発法人物質・材料研究機構 2024-01-25 WO disclosed
US-9500950-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2016-11-22 US disclosed
US-20160062237-A1 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2016-03-03 US disclosed
US-9213236-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2015-12-15 US disclosed
US-20140162190-A1 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2014-06-12 US disclosed
US-8697343-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2014-04-15 US disclosed
US-20090202945-A1 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2009-08-13 US disclosed