SCHEMBL1935525

SCHEMBL1935525

NC(=O)OC1(N)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 2/20 0.31
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 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 SCHEMBL2480640 0.98 TSHR (0.34) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
SCHEMBL28672980 0.97 TSHR (0.32) TSHRCYP2C19
SCHEMBL715609 0.82 TSHR (0.37) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
SCHEMBL2831752 0.80 TSHR (0.36) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
SCHEMBL2832088 0.80 TSHR (0.36) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
SCHEMBL2192555 0.80 TSHR (0.36) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
SCHEMBL1840485 0.80 TSHR (0.36) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL11579187 0.78 TSHR (0.34) TSHRCYP2C19ALDH1A1SMN1; SMN2LMNA
SCHEMBL1020071 0.77 ALDH1A1 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2
SCHEMBL3164465 0.77 TSHR (0.37) TSHRCYP2C19

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
US-11485118-B2 Resin molded product AICELLO CORPORATION (JP) 2022-11-01 US disclosed
US-20200283590-A1 RESIN MOLDED PRODUCT AICELLO CORPORATION (JP) 2020-09-10 US disclosed
US-20190300665-A1 RESIN MOLDED PRODUCT AICELLO CORPORATION (JP) 2019-10-03 US disclosed
CN-104066431-B Pyrazine kinase inhibitors 波托拉医药品公司 2017-03-08 CN disclosed
CN-103282352-B Benzamides and nicotinamide as SYK regulator 波托拉医药品公司 2016-08-10 CN disclosed
CN-101801995-B Antibacterial peptide AMP THERAPEUTICS GMBH & CO KG 2013-10-30 CN disclosed
CN-103339111-A Bicyclic acetyl-CoA carboxylase inhibitors NOVARTIS AG 2013-10-02 CN disclosed
EP-2331507-A2 HETEROCYCLIC CARBOXAMIDE COMPOUNDS Astellas Pharma Inc. (JP) 2011-06-15 EP disclosed
CN-101801995-A Antibacterial peptide AMP THERAPEUTICS GMBH & CO KG 2010-08-11 CN disclosed
WO-2010032875-A2 HETEROCYCLIC CARBOXAMIDE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2010-03-25 WO disclosed
EP-2106396-A2 CHEMICAL COMPOUNDS 637: PYRIDOPYRIMIDINEDIONES AS PDE4 INHIBITORS AstraZeneca AB (SE) 2009-10-07 EP disclosed
WO-2008084223-A2 CHEMICAL COMPOUNDS 637: PYRIDOPYRIMIDINEDIONES AS PDE4 INHIBITORS ASTRAZENECA AB (SE) 2008-07-17 WO disclosed