SCHEMBL4285074

SCHEMBL4285074

O=S(=O)(Nc1nccc(Oc2ccc3[nH]ccc3c2)n1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.48
NPSR1 Q6W5P4 1/20 0.47
SLC40A1 Q9NP59 3/20 0.43
ALDH1A1 P00352 1/20 0.43
KDR P35968 6/20 0.42
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
JAK2 O60674 1/20 0.41
CYP19A1 P11511 1/20 0.41
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
FLT3 P36888 1/20 0.40
MERTK Q12866 1/20 0.40
NTRK2 Q16620 1/20 0.40
PTGES2 Q9H7Z7 1/20 0.39

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
SCHEMBL4293493 0.84 JAK2 (0.44) KDRJAK2FGFR1FLT1FLT4
SCHEMBL4281016 0.81 KDR (0.54) KDRJAK2FGFR1FLT1FLT4
SCHEMBL4284781 0.77 KDR (0.61) KDRFGFR1FLT1FLT4FLT3
SCHEMBL13805558 0.76 KDR (0.41) KDRJAK2FGFR1FLT1FLT4
SCHEMBL4287622 0.74 SYK (0.48) KDRJAK2FGFR1FLT1FLT4
SCHEMBL4279265 0.74 SYK (0.46) KDRJAK2FGFR1FLT1FLT4
SCHEMBL2498684 0.73 LTA4H (0.40) NPSR1KDR
SCHEMBL4287649 0.73 SYK (0.47) KDRJAK2FGFR1FLT1FLT4
SCHEMBL2509875 0.72 AHR (0.45) NPSR1KDRJAK2
SCHEMBL38666234 0.72 NPSR1 (0.67) NPSR1SLC40A1ALDH1A1TSHRSMN1; SMN2

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-20090149467-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-06-11 US claimed
EP-1934200-A1 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2008-06-25 EP claimed
WO-2007035309-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-03-29 WO claimed
US-20090149467-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-06-11 US disclosed
US-20090149467-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-06-11 US disclosed
US-20090149467-A1 Tyrosine Kinase Inhibitors MERCK & CO., INC. (US) 2009-06-11 US disclosed
EP-1934200-A1 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2008-06-25 EP disclosed
WO-2007035309-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-03-29 WO 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 (1 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-20090149467-A1 Tyrosine Kinase Inhibitors ABL1, MET, ERBB2 PIK3CD 365/4885NPSR1 2771/4885SLC40A1 2937/4885

“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.