SCHEMBL3762545

SCHEMBL3762545

O=S(=O)(Oc1ccccc1-c1[c]nccc1)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.34
DRD3 P35462 5/20 0.34
DRD4 P21917 4/20 0.34
SLC22A12 Q96S37 1/20 0.33
DRD1 P21728 2/20 0.33
DRD5 P21918 2/20 0.33
GPR3 P46089 1/20 0.33
HTR1D P28221 1/20 0.32
HTR5A P47898 1/20 0.32
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
CHRM1 P11229 1/20 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
SCHEMBL7023211 0.78 DRD2 (0.42) DRD2DRD3DRD4SLC22A12DRD1
SCHEMBL16926997 0.77 DRD2 (0.41) DRD2DRD3DRD4SLC22A12DRD1
SCHEMBL367003 0.74 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1423686 0.74 CYP11B1 (0.41) DRD2DRD3DRD4SLC22A12DRD1
SCHEMBL1712875 0.73 DRD2 (0.43) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1971146 0.72 ALDH1A1 (0.44) METAP2PTGS2
SCHEMBL3762549 0.71 ADORA2A (0.34) DRD2DRD3DRD4DRD1DRD5
SCHEMBL1773804 0.71 METAP2 (0.53) METAP2METAP1PDE4APDE4CPDE4D
SCHEMBL28166225 0.71 PTGS2 (0.41) DRD2DRD3DRD4SLC22A12DRD1
Iodide SCHEMBL8733616 0.71 DRD2 (0.41) DRD2DRD3DRD4SLC22A12DRD1

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
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
EP-2029570-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-04 EP disclosed
WO-2007141504-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2007-12-13 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-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA DRD2 2600/4885DRD3 2582/4885DRD4 3027/4885

“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.