SCHEMBL22207871

SCHEMBL22207871

O=C(C(c1ccccc1)N1CCCC1)N1CCC(c2cccc(OC(F)(F)F)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ BCL9 O00512 1/20 0.44
▸ CTNNB1 P35222 1/20 0.44
▸ MGLL Q99685 3/20 0.42
▸ FAAH O00519 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HCRTR2 O43614 3/20 0.41
▸ HSD11B1 P28845 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ UGCG Q16739 1/20 0.39

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
SCHEMBL22207845 0.86 TRPV1 (0.52) BCL9CTNNB1MGLLFAAHNOTUM
SCHEMBL30870379 0.86 TRPV1 (0.52) BCL9CTNNB1MGLLFAAHNOTUM
SCHEMBL21381632 0.78 NOTUM (0.52) BCL9CTNNB1MGLLFAAHNOTUM
SCHEMBL23211936 0.78 NOTUM (0.52) BCL9CTNNB1MGLLFAAHNOTUM
SCHEMBL28669543 0.73 LMNA (0.52) NOTUMLMNAGAAUGCG
SCHEMBL18920471 0.73 LMNA (0.52) NOTUMLMNAGAAUGCG
SCHEMBL25864470 0.73 GPR119 (0.52) BCL9CTNNB1MGLLFAAHHCRTR2
SCHEMBL23148995 0.73 NOTUM (0.50) BCL9CTNNB1MGLLNOTUMHCRTR2
SCHEMBL30065306 0.72 LMNA (0.69) ALDH1A1LMNAGAATSHRMEN1
SCHEMBL22984288 0.72 DRD2 (0.47) BCL9CTNNB1MGLLNOTUMHCRTR2

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-3908580-A1 (2,5-DIOXOPYRROLIDIN-1-YL)(PHENYL)-ACETAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES UNIWERSYTET JAGIELLONSKI (PL) 2021-11-17 — — EP claimed
WO-2020145831-A1 (2,5-DIOXOPYRROLIDIN-L-YL)(PHENYL)-ACETAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES Uniwersytet Jagielloński (PL) 2020-07-16 — — WO claimed
EP-3908580-A1 (2,5-DIOXOPYRROLIDIN-1-YL)(PHENYL)-ACETAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES UNIWERSYTET JAGIELLONSKI (PL) 2021-11-17 — — EP disclosed
WO-2020145831-A1 (2,5-DIOXOPYRROLIDIN-L-YL)(PHENYL)-ACETAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF NEUROLOGICAL DISEASES Uniwersytet Jagielloński (PL) 2020-07-16 — — WO disclosed
US-20160263066-A1 ISOTOPICALLY MODIFIED COMPOUNDS AND THEIR USE AS FOOD SUPPLEMENTS BIOJIVA LLC 2016-09-15 — — 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 (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-20160263066-A1 ISOTOPICALLY MODIFIED COMPOUNDS AND THEIR USE AS FOOD SUPPLEMENTS GPX4, FABP6, SLC25A20 BCL9 3472/4885CTNNB1 1509/4885MGLL 1144/4885

“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.

Send feedback