SCHEMBL16126056

SCHEMBL16126056

Cc1ccc2c3ccnc(C)c3n(CCN(C)CCO)c2c1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 16/20 0.57
▸ HTR2A P28223 2/20 0.57
▸ HTR2C P28335 2/20 0.57
▸ HASPIN Q8TF76 5/20 0.52

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
SCHEMBL16123583 0.90 DYRK1A (0.56) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL16123601 0.87 DYRK1A (0.78) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL30629773 0.87 DYRK1A (0.78) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL16126063 0.87 DYRK1A (0.74) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL14550801 0.80 HASPIN (0.65) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL14550824 0.78 DYRK1A (0.57) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL16126058 0.78 DYRK1A (0.57) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL30939988 0.77 DYRK1A (0.71) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL16123659 0.77 DYRK1A (0.71) DYRK1AHTR2AHTR2CHASPIN
SCHEMBL15236152 0.77 HASPIN (0.74) DYRK1AHTR2AHTR2CHASPIN

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
US-20170298059-A1 COMPOUNDS FOR BONE GROWTH OSSIFI THERAPEUTICS LLC 2017-10-19 — — US disclosed
US-9540365-B2 Compounds for bone growth OSTEOQC INC. (CA) 2017-01-10 — — US disclosed
US-20140288068-A1 ALKYL-AMINE HARMINE DERIVATIVES FOR PROMOTING BONE GROWTH OSSIFI INC. (US) 2014-09-25 — — 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 (2 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 DYRK1A 4508/4885HTR2A 4576/4885HTR2C 4183/4885
US-20140288068-A1 ALKYL-AMINE HARMINE DERIVATIVES FOR PROMOTING BONE GROWTH TPH1, TPH2, HTR5A DYRK1A 3234/4885HTR2A 21/4885HTR2C 33/4885

“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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