SCHEMBL22018813

SCHEMBL22018813

CC(C)N1CC[C@H](O)[C@H](N)C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GBA1 P04062 1/20 0.31
DPP4 P27487 2/20 0.30

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
SCHEMBL23970328 1.00 PARP1 (0.32) PARP1ALDH1A1GBA1DPP4
SCHEMBL22018814 1.00 PARP1 (0.32) PARP1ALDH1A1GBA1DPP4
SCHEMBL18399522 1.00 PARP1 (0.32) PARP1ALDH1A1GBA1DPP4
SCHEMBL27305028 0.88 DRD2 (0.36) PARP1
SCHEMBL24789568 0.85 HRH3 (0.33) ALDH1A1
SCHEMBL24789565 0.85 HRH3 (0.33) ALDH1A1
SCHEMBL19879501 0.83 OPRK1 (0.30) DPP4
SCHEMBL19768960 0.83 OPRK1 (0.30) DPP4
SCHEMBL9004988 0.83 OPRK1 (0.30) DPP4
SCHEMBL19768934 0.83 OPRK1 (0.30) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10828290-B2 Thiazolecarboxamides and pyridinecarboxamide compounds useful as pim kinase inhibitors INCYTE CORPORATION (US) 2020-11-10 US disclosed
US-20200155527-A1 THIAZOLECARBOXAMIDES AND PYRIDINECARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE HOLDINGS CORPORATION 2020-05-21 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-20200155527-A1 THIAZOLECARBOXAMIDES AND PYRIDINECARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS PIM2, PIM1, PIM3 PARP1 1418/4885ALDH1A1 1912/4885GBA1 2724/4885
US-10828290-B2 Thiazolecarboxamides and pyridinecarboxamide compounds useful as pim kinase inhibitors PIM2, PIM1, PIM3 PARP1 1418/4885ALDH1A1 1912/4885GBA1 2724/4885

“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.