SCHEMBL12287315

SCHEMBL12287315

COc1ccc2c3ccnc(C(F)(F)F)c3n(CCCCN)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 11/20 1.00
▸ DYRK2 Q92630 2/20 1.00
▸ DYRK1A Q13627 10/20 0.68

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
SCHEMBL15236175 0.86 HASPIN (0.75) HASPINDYRK2DYRK1A
SCHEMBL16123595 0.85 HASPIN (0.73) HASPINDYRK2DYRK1A
SCHEMBL30296700 0.84 HASPIN (1.00) HASPINDYRK2DYRK1A
SCHEMBL30939880 0.84 HASPIN (1.00) HASPINDYRK2DYRK1A
SCHEMBL15228128 0.84 HASPIN (1.00) HASPINDYRK2DYRK1A
SCHEMBL30939966 0.84 HASPIN (0.72) HASPINDYRK2DYRK1A
SCHEMBL16123625 0.84 HASPIN (0.72) HASPINDYRK2DYRK1A
SCHEMBL16123609 0.84 DYRK1A (0.72) HASPINDYRK2DYRK1A
SCHEMBL30939975 0.84 DYRK1A (0.72) HASPINDYRK2DYRK1A
SCHEMBL15227864 0.84 HASPIN (0.72) HASPINDYRK2DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130231360-A1 Beta-Carbolines as Inhibitors of Haspin and DYRK Kinases THE BRIGHAM AND WOMEN S HOSPITAL, INC. (US) 2013-09-05 — — US claimed
CN-113416187-B Alkylamine harmine derivatives for promoting bone growth 奥斯菲治疗有限公司 2024-07-19 — — CN disclosed
CN-113416187-A Alkylamine peganine derivatives for promoting bone growth 奥斯特克有限公司 2021-09-21 — — CN disclosed
CN-105120863-B Alkylamine peganine derivatives for promoting bone growth 奥斯特克有限公司 2021-06-04 — — CN disclosed
US-20130231360-A1 Beta-Carbolines as Inhibitors of Haspin and DYRK Kinases THE BRIGHAM AND WOMEN S HOSPITAL, INC. (US) 2013-09-05 — — US disclosed
WO-2011133795-A2 BETA-CARBOLINES AS INHIBITORS OF HASPIN AND DYRK KINASES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2011-10-27 — — 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-20130231360-A1 Beta-Carbolines as Inhibitors of Haspin and DYRK Kinases HASPIN, HIPK1, HIPK2 HASPIN 1/4885DYRK2 19/4885DYRK1A 25/4885

“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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