SCHEMBL19689719

SCHEMBL19689719

Cc1cc(-c2ccc3c(n2)N(C(=O)Nc2cc(OCC(O)CO)ccn2)[C@H]2CCN3C2)ccn1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.35
▸ ABL1 P00519 1/20 0.34
▸ WNT3A P56704 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ NOS1 P29475 1/20 0.32
▸ NOS2 P35228 1/20 0.32
▸ MAPK1 P28482 3/20 0.32
▸ RAF1 P04049 1/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ MET P08581 1/20 0.32
▸ PIK3C3 Q8NEB9 1/20 0.31
▸ AAK1 Q2M2I8 4/20 0.31
▸ DAPK1 P53355 2/20 0.31
▸ MKNK1 Q9BUB5 2/20 0.31
▸ MYLK2 Q9H1R3 2/20 0.31
▸ MKNK2 Q9HBH9 2/20 0.31
▸ BMP2K Q9NSY1 2/20 0.31
▸ MTOR P42345 1/20 0.31

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
SCHEMBL17778746 1.00 CSF1R (0.35) CSF1RABL1WNT3ATLR9TLR8
SCHEMBL19689720 1.00 CSF1R (0.35) CSF1RABL1WNT3ATLR9TLR8
SCHEMBL17768146 0.90 RAF1 (0.34) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL17768148 0.90 RAF1 (0.34) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL19706670 0.90 RAF1 (0.34) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL19706747 0.90 WNT3A (0.33) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL17768229 0.90 WNT3A (0.33) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL17768231 0.90 WNT3A (0.33) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL17618758 0.89 WNT3A (0.35) ABL1WNT3ATLR9TLR8TLR7
SCHEMBL19689755 0.89 KIF18A (0.34) WNT3ATLR9TLR8TLR7MAPK1

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
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 — — 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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 CSF1R 1896/4885ABL1 3898/4885WNT3A 4482/4885

“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.

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