SCHEMBL1972309

SCHEMBL1972309

CCOC(=O)c1ncc2cc(-c3cccc(C(F)(F)F)c3)sc2c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
GRIN2B Q13224 4/20 0.44
GRIN1 Q05586 2/20 0.44
KDM4E B2RXH2 5/20 0.43
HSP90AA1 P07900 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.41
CDC7 O00311 1/20 0.41
DBF4 Q9UBU7 1/20 0.41
CTSA P10619 1/20 0.41
GRM5 P41594 1/20 0.40
HTT P42858 1/20 0.40
DHODH Q02127 1/20 0.40
APP P05067 1/20 0.40

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
SCHEMBL1974111 0.92 MAPT (0.52) MAPTMEN1KMT2AKDM4EHSP90AA1
SCHEMBL1973030 0.82 MAPT (0.55) MAPTMEN1KMT2AKDM4EHSP90AA1
SCHEMBL1974914 0.82 ALDH1A1 (0.40) MAPTMEN1KMT2AGRIN2BGRIN1
SCHEMBL1975510 0.80 MAPT (0.55) MAPTMEN1KMT2AKDM4EHSP90AA1
SCHEMBL968156 0.79 EGLN1 (0.48)
SCHEMBL1973428 0.75 SMN1; SMN2 (0.41) MAPTKMT2AKDM4ESMN1; SMN2TRPM8
SCHEMBL2880970 0.73 MAPT (0.60) MAPTMEN1KMT2AKDM4EHSP90AA1
SCHEMBL1973778 0.73 ALDH1A1 (0.40) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL23794687 0.73 MAPT (0.64) MAPTMEN1KMT2AGRIN2BGRIN1
SCHEMBL9586081 0.73 MAPT (0.55) MAPTMEN1KMT2AGRIN2BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9000006-B2 Thienopyridine compounds, and methods of use thereof FIBROGEN, INC. (US) 2015-04-07 US disclosed
US-20140221422-A1 NOVEL THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2014-08-07 US disclosed
US-8703795-B2 Thienopyridine compounds, and methods of use thereof FIBROGEN, INC. (US) 2014-04-22 US disclosed
EP-1866318-B1 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN INC (US) 2011-06-22 EP disclosed
EP-1866318-A2 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2007-12-19 EP disclosed
WO-2006094292-A2 THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF FIBROGEN, INC. (US) 2006-09-08 WO disclosed
US-20060199836-A1 Novel thienopyridine compounds, and methods of use thereof FIBROGEN, INC. 2006-09-07 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 (2 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-20140221422-A1 NOVEL THIENOPYRIDINE COMPOUNDS, AND METHODS OF USE THEREOF HIF1AN, HIF1A, EGLN2 MAPT 3256/4885MEN1 4654/4885KMT2A 1140/4885
US-20060199836-A1 Novel thienopyridine compounds, and methods of use thereof HIF1AN, HIF1A, EGLN2 MAPT 3256/4885MEN1 4654/4885KMT2A 1140/4885

“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.