SCHEMBL22612643

SCHEMBL22612643

C[C@@H]1CN(C(=O)O)CC[C@@H]1N

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.33
▸ ACHE P22303 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CHRNA7 P36544 1/20 0.31
▸ SMYD3 Q9H7B4 4/20 0.31
▸ GNAI3 P08754 1/20 0.31
▸ GNAO1 P09471 1/20 0.31
▸ GNAI1 P63096 1/20 0.31
▸ GAA P10253 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
SCHEMBL23885771 1.00 ALDH1A1 (0.33) ALDH1A1ACHENPC1LMNAMEN1
SCHEMBL29183209 1.00 ALDH1A1 (0.33) ALDH1A1ACHENPC1LMNAMEN1
SCHEMBL21748791 1.00 ALDH1A1 (0.33) ALDH1A1ACHENPC1LMNAMEN1
SCHEMBL3116551 1.00 ALDH1A1 (0.33) ALDH1A1ACHENPC1LMNAMEN1
SCHEMBL3124376 1.00 ALDH1A1 (0.33) ALDH1A1ACHENPC1LMNAMEN1
Hydrochloric Acid SCHEMBL28502789 0.98 GNAI3 (0.33) ALDH1A1ACHENPC1LMNAMEN1
Hydrochloric Acid SCHEMBL28502790 0.98 GNAI3 (0.33) ALDH1A1ACHENPC1LMNAMEN1
SCHEMBL22496874 0.84 LMNA (0.37) ALDH1A1ACHENPC1LMNAMEN1
SCHEMBL2377686 0.84 EPHX2 (0.37) ALDH1A1NPC1CHRNA7
SCHEMBL16169058 0.84 EPHX2 (0.37) ALDH1A1NPC1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174664-A1 BICYCLIC AMINES AS CDK2 INHIBITORS INCYTE CORPORATION 2024-05-30 — — US disclosed
US-20240150340-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED 2024-05-09 — — US disclosed
WO-2024077216-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS INCORPORATED (US) 2024-04-11 — — WO disclosed
US-11851426-B2 Bicyclic amines as CDK2 inhibitors INCYTE CORPORATION (US) 2023-12-26 — — US disclosed
US-20230257394-A1 CDK Inhibitors And Their Use As Pharmaceuticals PRELUDE THERAPEUTICS INCORPORATED 2023-08-17 — — US disclosed
WO-2023150612-A1 CDK INHIBITORS AND THEIR USE AS PHARMACEUTICALS PRELUDE THERAPEUTICS, INCORPORATED (US) 2023-08-10 — — WO disclosed
US-20230024173-A1 IMIDAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2023-01-26 — — US disclosed
WO-2021072232-A1 BICYCLIC AMINES AS CDK2 INHIBITORS INCYTE CORPORATION (US) 2021-04-15 — — WO disclosed
US-20210107901-A1 BICYCLIC AMINES AS CDK2 INHIBITORS INCYTE CORPORATION 2021-04-15 — — US disclosed
US-20210047294-A1 IMIDAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2021-02-18 — — US disclosed
US-20210017156-A1 PYRAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2021-01-21 — — US disclosed
US-20200347067-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2020-11-05 — — US disclosed
WO-2020223469-A1 N-(1-(METHYLSULFONYL)PIPERIDIN-4-YL)-4,5-DI HYDRO-1H-IMIDAZO[4,5-H]QUINAZOLIN-8-AMINE DERIVATIVES AND RELATED COMPOUNDS AS CYCLIN-DEPENDENT KINASE 2 (CDK2) INHIBITORS FOR TREATING CANCER INCYTE CORPORATION (US) 2020-11-05 — — 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 (9 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-20210017156-A1 PYRAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK2AP2, CDK4 ALDH1A1 3715/4885ACHE 4492/4885NPC1 3538/4885
US-20210047294-A1 IMIDAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK4, CDK2AP2 ALDH1A1 3723/4885ACHE 4631/4885NPC1 3231/4885
US-20240150340-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK1, CDK3 ALDH1A1 2921/4885ACHE 3685/4885NPC1 3950/4885
US-20230024173-A1 IMIDAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK4, CDK2AP2 ALDH1A1 3723/4885ACHE 4631/4885NPC1 3231/4885
US-11851426-B2 Bicyclic amines as CDK2 inhibitors CDK2, CDK1, CCNI ALDH1A1 2576/4885ACHE 2870/4885NPC1 3516/4885
US-20230257394-A1 CDK Inhibitors And Their Use As Pharmaceuticals CDK6, CDK1, CDK3 ALDH1A1 2921/4885ACHE 3685/4885NPC1 3950/4885
US-20240174664-A1 BICYCLIC AMINES AS CDK2 INHIBITORS CDK2, CDK1, CCNI ALDH1A1 2576/4885ACHE 2870/4885NPC1 3516/4885
US-20200347067-A1 TRICYCLIC AMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK1, CCNI ALDH1A1 4033/4885ACHE 2734/4885NPC1 3606/4885
US-20210107901-A1 BICYCLIC AMINES AS CDK2 INHIBITORS CDK2, CDK1, CCNI ALDH1A1 2576/4885ACHE 2870/4885NPC1 3516/4885

“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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