SCHEMBL20179726

SCHEMBL20179726

Cc1c(F)ccc2c1OCCCC2=O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.33
MAOB P27338 4/20 0.32
MAOA P21397 3/20 0.32
PDE4A P27815 1/20 0.31
GRM5 P41594 2/20 0.31
PRKCI P41743 1/20 0.30
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 1/20 0.30
CXCR2 P25025 1/20 0.30
CYP2A6 P11509 1/20 0.30
USP8 P40818 1/20 0.30
USP7 Q93009 1/20 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
SCHEMBL20165370 0.83 MAOB (0.33) PSMB5MAOBMAOAGRM5PRKCI
SCHEMBL29756874 0.81 ESR1 (0.49) PSMB5MAOBMAOAPRKCILTB4R
SCHEMBL20165416 0.81 ESR1 (0.49) PSMB5MAOBMAOAPRKCILTB4R
SCHEMBL20165162 0.81 NOTUM (0.39) PSMB5MAOBMAOAPDE4AGRM5
SCHEMBL23977145 0.77 CYP19A1 (0.44) MAOBMAOAGRM5CYP2A6
SCHEMBL30029059 0.77 CYP19A1 (0.44) MAOBMAOAGRM5CYP2A6
SCHEMBL23870268 0.76 HTR2A (0.32)
SCHEMBL20165267 0.74 PSMB5 (0.44) PSMB5MAOBMAOAPRKCILTB4R
SCHEMBL24543491 0.73 MAOA (0.37) MAOBMAOAPRKCICYP2A6
SCHEMBL7761381 0.73 TDP2 (0.44) PSMB5MAOBMAOAGRM5LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PSMB5 357/4885MAOB 298/4885MAOA 196/4885
US-11149031-B2 Substituted N-(3-fluoropropyl)-pyrrolidine compounds, processes for their preparation and therapeutic uses thereof ESR1, CYP19A1, ESR2 PSMB5 477/4885MAOB 181/4885MAOA 107/4885
US-20220204488-A1 Novel Substituted N-(3-Fluoropropyl)-Pyrrolidine Compounds, Processes for their Preparation and Therapeutic Uses Thereof ESR1, CYP19A1, GPER1 PSMB5 332/4885MAOB 344/4885MAOA 223/4885

“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.