SCHEMBL8549323

SCHEMBL8549323

COC(=O)c1c(C(=O)O)cc(Br)c(OC)c1Br

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.54
GPR35 Q9HC97 1/20 0.49
TPMT P51580 1/20 0.45
LCK P06239 1/20 0.45
FYN P06241 1/20 0.45
HPGD P15428 3/20 0.43
ALDH1A1 P00352 2/20 0.43
PTPN1 P18031 2/20 0.42
MAPT P10636 2/20 0.40
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
LMNA P02545 1/20 0.38
KDM4E B2RXH2 2/20 0.37
TSHR P16473 1/20 0.37
APOBEC3A P31941 1/20 0.37
HTT P42858 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
POLB P06746 1/20 0.37
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36

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
SCHEMBL8550905 0.90 HSD17B10 (0.45) HSD17B10GPR35TPMTHPGDALDH1A1
SCHEMBL8549612 0.88 HSD17B10 (0.59) HSD17B10GPR35TPMTLCKFYN
SCHEMBL8551259 0.86 HSD17B10 (0.41) HSD17B10GPR35TPMTHPGDALDH1A1
SCHEMBL8546447 0.83 HPGD (0.46) HSD17B10HPGDALDH1A1MAPTLMNA
SCHEMBL8548592 0.82 THRA (0.50) HSD17B10ALDH1A1MAPTTSHRPOLB
SCHEMBL27851655 0.78 HSD17B10 (0.62) HSD17B10GPR35TPMTLCKFYN
SCHEMBL6825228 0.78 HSD17B10 (0.53) HSD17B10GPR35TPMTLCKFYN
SCHEMBL4113651 0.77 CA2 (0.48) HSD17B10TPMTHPGDALDH1A1PTPN1
SCHEMBL2970067 0.75 HSD17B10 (0.70) HSD17B10GPR35TPMTLCKFYN
SCHEMBL4288497 0.74 LCK (0.41) HSD17B10LCKFYNHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0825187-A1 Condensed pyridazinyl guanidines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-25 EP disclosed