SCHEMBL20179693

SCHEMBL20179693

Ic1ccc(O[C@H]2CCNC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 1/20 0.53
▸ CHRNA4 P43681 1/20 0.53
▸ HRH1 P35367 2/20 0.52
▸ PRKCZ Q05513 1/20 0.51
▸ ROCK1 Q13464 3/20 0.48
▸ HTR2C P28335 1/20 0.47
▸ HTR2B P41595 1/20 0.47
▸ CHUK O15111 1/20 0.43
▸ DYRK3 O43781 1/20 0.43
▸ ROCK2 O75116 1/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ PRKACA P17612 1/20 0.43
▸ RPS6KB1 P23443 1/20 0.43
▸ AKT1 P31749 1/20 0.43
▸ CLK2 P49760 1/20 0.43
▸ PRKX P51817 1/20 0.43
▸ PRKG2 Q13237 1/20 0.43
▸ DYRK1A Q13627 1/20 0.43
▸ PRKG1 Q13976 1/20 0.43

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
SCHEMBL20124856 1.00 CHRNB2 (0.53) CHRNB2CHRNA4HRH1PRKCZROCK1
Hydrochloric Acid SCHEMBL22031560 0.98 CHRNB2 (0.51) CHRNB2CHRNA4HRH1PRKCZROCK1
Hydrochloric Acid SCHEMBL20165250 0.98 CHRNB2 (0.51) CHRNB2CHRNA4HRH1PRKCZROCK1
Hydrochloric Acid SCHEMBL20165251 0.98 CHRNB2 (0.51) CHRNB2CHRNA4HRH1PRKCZROCK1
SCHEMBL18689816 0.89 CHRNB2 (0.55) CHRNB2CHRNA4HRH1PRKCZROCK1
SCHEMBL3574466 0.89 HRH1 (0.66) CHRNB2CHRNA4HRH1ROCK1ROCK2
Hydrochloric Acid SCHEMBL15476748 0.87 HRH1 (0.63) CHRNB2CHRNA4HRH1ROCK1ROCK2
SCHEMBL14862725 0.84 SLC6A2 (0.53) HRH1HTR1ASLC6A2
SCHEMBL7000861 0.83 PRKCZ (0.56) CHRNB2CHRNA4HRH1PRKCZROCK1
SCHEMBL3133920 0.83 PRKCZ (0.56) CHRNB2CHRNA4HRH1PRKCZROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4005568-B1 SGLTS/DPP4 INHIBITOR AND APPLICATION THEREOF DONGBAO PURPLE STAR HANGZHOU BIOPHARMACEUTICAL CO LTD (CN) 2024-07-10 — — EP disclosed
US-20220204488-A1 Novel Substituted N-(3-Fluoropropyl)-Pyrrolidine Compounds, Processes for their Preparation and Therapeutic Uses Thereof SANOFI (FR) 2022-06-30 — — US disclosed
US-11149031-B2 Substituted N-(3-fluoropropyl)-pyrrolidine compounds, processes for their preparation and therapeutic uses thereof SANOFI (FR) 2021-10-19 — — US disclosed
US-20200361918-A1 NOVEL SUBSTITUTED N-(3-FLUOROPROPYL)-PYRROLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI-AVENTIS RECHERCHE & DEVELOPPEMENT (FR) 2020-11-19 — — US disclosed
WO-2018091153-A1 NOVEL SUBSTITUTED N-(3-FLUOROPROPYL)-PYRROLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2018-05-24 — — 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 (3 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-20200361918-A1 NOVEL SUBSTITUTED N-(3-FLUOROPROPYL)-PYRROLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF ESR1, CYP19A1, ESR2 CHRNB2 2851/4885CHRNA4 3145/4885HRH1 1389/4885
US-11149031-B2 Substituted N-(3-fluoropropyl)-pyrrolidine compounds, processes for their preparation and therapeutic uses thereof ESR1, CYP19A1, ESR2 CHRNB2 2744/4885CHRNA4 3002/4885HRH1 1180/4885
US-20220204488-A1 Novel Substituted N-(3-Fluoropropyl)-Pyrrolidine Compounds, Processes for their Preparation and Therapeutic Uses Thereof ESR1, CYP19A1, GPER1 CHRNB2 2473/4885CHRNA4 2706/4885HRH1 1420/4885

“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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