SCHEMBL1974662

SCHEMBL1974662

COC(=O)c1sc(Br)c(Br)c1CBr

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.46
HSD17B10 Q99714 4/20 0.46
TSHR P16473 4/20 0.46
MAPT P10636 3/20 0.46
PTPN1 P18031 1/20 0.37
RAF1 P04049 1/20 0.35
ALDH1A1 P00352 8/20 0.34
MEN1 O00255 3/20 0.34
HPGD P15428 6/20 0.33
NPSR1 Q6W5P4 2/20 0.33
PPARG P37231 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
LMNA P02545 3/20 0.33
MAPK1 P28482 1/20 0.33
GPR35 Q9HC97 1/20 0.33
ATM Q13315 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CASP3 P42574 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL6345016 0.83 MAPT (0.41) KMT2AHSD17B10TSHRMAPTALDH1A1
SCHEMBL21612060 0.79 KMT2A (0.54) KMT2AHSD17B10TSHRMAPTPTPN1
SCHEMBL1529858 0.76 MAPT (0.50) KMT2AHSD17B10TSHRMAPTPTPN1
SCHEMBL1973056 0.76 MAPT (0.50) KMT2AHSD17B10TSHRMAPTALDH1A1
SCHEMBL2682770 0.74 MAPT (0.48) KMT2AHSD17B10TSHRMAPTPTPN1
SCHEMBL15537262 0.74 KMT2A (0.48) KMT2AHSD17B10TSHRMAPTPTPN1
SCHEMBL1329709 0.74 MAPT (0.48) KMT2AHSD17B10TSHRMAPTPTPN1
SCHEMBL29137853 0.72 KMT2A (0.60) KMT2AHSD17B10TSHRMAPTALDH1A1
SCHEMBL1975048 0.71 KMT2A (0.43) KMT2AHSD17B10TSHRMAPTALDH1A1
SCHEMBL27029417 0.70 MAPT (0.48) KMT2AHSD17B10TSHRMAPTALDH1A1

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 KMT2A 1140/4885HSD17B10 3718/4885TSHR 2835/4885
US-20060199836-A1 Novel thienopyridine compounds, and methods of use thereof HIF1AN, HIF1A, EGLN2 KMT2A 1140/4885HSD17B10 3718/4885TSHR 2835/4885

“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.