SCHEMBL1974306

SCHEMBL1974306

COC(=O)c1ncc2c(Br)c(Br)sc2c1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
NPSR1 Q6W5P4 1/20 0.34
GPR35 Q9HC97 2/20 0.34
KDM4C Q9H3R0 1/20 0.33
KDM4E B2RXH2 4/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 2/20 0.32
COMT P21964 1/20 0.32
TSHR P16473 3/20 0.31
HSD17B10 Q99714 3/20 0.31
MAPT P10636 3/20 0.31
KMT2A Q03164 2/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
HIF1A Q16665 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
STAT3 P40763 1/20 0.31
MAPK1 P28482 2/20 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
SCHEMBL1975700 0.79 PTGS1 (0.39) EGLN1KDM4ESMN1; SMN2LMNAHSD17B10
SCHEMBL1809791 0.73 TP53 (0.47) EGLN1NPSR1KDM4ESMN1; SMN2LMNA
SCHEMBL1810341 0.72 EGLN1 (0.40) LCKEGLN1NPSR1KDM4ESMN1; SMN2
SCHEMBL1809247 0.72 KDM4E (0.47) LCKEGLN1KDM4ELMNAALDH1A1
SCHEMBL1810167 0.72 EGLN1 (0.40) LCKEGLN1NPSR1KDM4CKDM4E
SCHEMBL31636929 0.71 LCK (0.38) LCKNPSR1KDM4CKDM4ELMNA
SCHEMBL31016818 0.70 LCK (0.38) LCKNPSR1KDM4CKDM4ESMN1; SMN2
SCHEMBL31636618 0.70 LCK (0.38) LCKEGLN1NPSR1KDM4CKDM4E
SCHEMBL1971895 0.70 PTGS1 (0.39) KDM4ESMN1; SMN2HSD17B10MAPTALDH1A1
SCHEMBL31017018 0.70 EGLN1 (0.41) LCKEGLN1NPSR1KDM4ETSHR

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 LCK 3555/4885EGLN1 7/4885NPSR1 2300/4885
US-20060199836-A1 Novel thienopyridine compounds, and methods of use thereof HIF1AN, HIF1A, EGLN2 LCK 3555/4885EGLN1 7/4885NPSR1 2300/4885

“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.