SCHEMBL2264306

SCHEMBL2264306

Nc1ccc(O)c(C([AsH2])c2cccnc2)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
PDE4D Q08499 1/20 0.39
AXL P30530 2/20 0.38
MEN1 O00255 1/20 0.38
PSIP1 O75475 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
CFTR P13569 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GOPC Q9HD26 1/20 0.38
GAA P10253 1/20 0.37
CYP17A1 P05093 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP19A1 P11511 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL453949 0.84 SMN1; SMN2 (0.40) SMN1; SMN2PDE4DAXLMEN1PSIP1
SCHEMBL3977541 0.70 CHRNB4 (0.38) PDE4DAXLMEN1PSIP1MKNK1
SCHEMBL5681756 0.70 MEN1 (0.48) SMN1; SMN2MEN1CFTRGOPCGAA
SCHEMBL17064640 0.68 SMN1; SMN2 (0.65) SMN1; SMN2AXLMEN1PSIP1MKNK1
SCHEMBL8545068 0.68 CYP17A1 (0.58) SMN1; SMN2PDE4DCFTRSLC6A2SLC6A4
SCHEMBL28478132 0.67 ALDH1A1 (0.41) SMN1; SMN2MEN1SLC6A2SLC6A4SLC6A3
SCHEMBL31090354 0.66 SMN1; SMN2 (0.72) SMN1; SMN2AXLMEN1PSIP1MKNK1
SCHEMBL27593798 0.66 KDM4E (0.40) SMN1; SMN2MEN1SLC6A2SLC6A3GAA
SCHEMBL5684882 0.66 AXL (0.59) AXLMEN1PSIP1MKNK1MKNK2
SCHEMBL9161522 0.66 MEN1 (0.40) SMN1; SMN2MEN1SLC6A2SLC6A3GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011085140-A1 THICKENED HAIR COLOURANT AND BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2011-07-14 WO disclosed
US-7204861-B2 Hair coloring compositions THE PROCTER & GAMBLE COMPANY (US) 2007-04-17 US disclosed
US-20040237218-A1 Hair colouring compositions WELLA OPERATIONS US, LLC 2004-12-02 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 (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-20040237218-A1 Hair colouring compositions COXFA4L2, CYBA, MT-CO3 SMN1; SMN2 3041/4885PDE4D 2415/4885AXL 3544/4885

“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.