SCHEMBL19458950

SCHEMBL19458950

COc1ccc2c3ccnc(C(F)(F)F)c3n(CCNC(C)O)c2c1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 4/20 0.66
▸ DYRK2 Q92630 1/20 0.66
▸ DYRK1A Q13627 17/20 0.52
▸ HTR2A P28223 1/20 0.48
▸ HTR2C P28335 1/20 0.48

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
SCHEMBL16130001 0.85 HASPIN (0.67) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939975 0.81 DYRK1A (0.72) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123609 0.81 DYRK1A (0.72) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL12287315 0.80 HASPIN (1.00) HASPINDYRK2DYRK1A
SCHEMBL16130002 0.79 HASPIN (0.67) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16102319 0.79 HASPIN (0.70) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123504 0.79 HASPIN (0.64) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939918 0.79 HASPIN (0.64) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939968 0.79 HASPIN (0.70) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123584 0.78 HASPIN (0.66) HASPINDYRK2DYRK1AHTR2AHTR2C

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-20170298059-A1 COMPOUNDS FOR BONE GROWTH OSSIFI THERAPEUTICS LLC 2017-10-19 — — 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-20170298059-A1 COMPOUNDS FOR BONE GROWTH FGF1, FGF2, BMP2 HASPIN 1246/4885DYRK2 4607/4885DYRK1A 4508/4885

“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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