SCHEMBL3740600

SCHEMBL3740600

CCOC(=O)c1c(N)sc2c1CC(C)(C)NC2(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.57
KDM4E B2RXH2 6/20 0.55
MEN1 O00255 5/20 0.55
ALDH1A1 P00352 8/20 0.51
MAPT P10636 7/20 0.51
GAA P10253 5/20 0.51
HPGD P15428 5/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HSD17B10 Q99714 3/20 0.50
RXFP1 Q9HBX9 2/20 0.50
ALOX15 P16050 2/20 0.50
MAPK1 P28482 1/20 0.50
UBE2N P61088 1/20 0.50
LMNA P02545 1/20 0.50
THRB P10828 1/20 0.50
ADORA1 P30542 2/20 0.49
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
POLB P06746 1/20 0.48
RECQL P46063 1/20 0.48

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
SCHEMBL21247315 0.79 ALDH1A1 (0.54) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL4090933 0.78 KMT2A (0.66) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL3760020 0.77 ALDH1A1 (0.51) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL21247270 0.77 ALDH1A1 (0.51) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL18300329 0.76 KMT2A (0.64) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL18300328 0.76 KMT2A (0.48) KMT2AKDM4EMEN1ALDH1A1SMN1; SMN2
SCHEMBL3760601 0.73 MAP2K2 (0.56) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL22533528 0.73 ALDH1A1 (0.61) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL18300097 0.73 KMT2A (0.61) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL8290355 0.72 KMT2A (1.00) KMT2AKDM4EMEN1ALDH1A1RXFP1

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-9988395-B2 Antiparasitic compositions and methods utilizing substituted 5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-C]pyridine derivatives THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2018-06-05 US disclosed
US-20170349606-A1 ANTIPARASITIC COMPOSITIONS AND METHODS UTILIZING SUBSTITUTED 5,5,7,7-TETRAMETHYL-4,5,6,7-TETRAHYDROTHIENO[2,3-C] PYRIDINE DERIVATIVES THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-12-07 US disclosed
US-20160362420-A1 Antiparasitic Compositions and Methods Utilizing Substituted 5,5,7,7-Tetramethyl- 4,5,6,7-Tetrahydrothieno[2,3-C]Pyridine Derivatives BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-12-15 US disclosed
US-20160362420-A1 Antiparasitic Compositions and Methods Utilizing Substituted 5,5,7,7-Tetramethyl- 4,5,6,7-Tetrahydrothieno[2,3-C]Pyridine Derivatives BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-12-15 US disclosed
US-8338623-B2 N-{3-[(2,5-dimethylmorpholin-4-yl)carbonyl]-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl}hexahydro-2,5-methanopentalene-3a(1H)-carboxamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBVIE INC. (US) 2012-12-25 US disclosed
EP-2176219-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2010-04-21 EP disclosed
WO-2009009550-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 WO disclosed
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170349606-A1 ANTIPARASITIC COMPOSITIONS AND METHODS UTILIZING SUBSTITUTED 5,5,7,7-TETRAMETHYL-4,5,6,7-TETRAHYDROTHIENO[2,3-C] PYRIDINE DERIVATIVES COX5B, COX6C, CYCS KMT2A 3427/4885KDM4E 1033/4885MEN1 3083/4885
US-20160362420-A1 Antiparasitic Compositions and Methods Utilizing Substituted 5,5,7,7-Tetramethyl- 4,5,6,7-Tetrahydrothieno[2,3-C]Pyridine Derivatives COX5B, COX6C, CYCS KMT2A 3427/4885KDM4E 1033/4885MEN1 3083/4885
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 KMT2A 2505/4885KDM4E 2443/4885MEN1 3065/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.