SCHEMBL23701459

SCHEMBL23701459

CN(C)CCCN(C)c1ccc(N2CC3CN(C(=O)OC(C)(C)C)CC3C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.46
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
NR1H2 P55055 1/20 0.41
PDE10A Q9Y233 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
LIPE Q05469 2/20 0.38
KCNK3 O14649 2/20 0.38
KCNK9 Q9NPC2 2/20 0.38

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
SCHEMBL27400053 1.00 GPR119 (0.46) GPR119JAK2JAK1NR1H2PDE10A
SCHEMBL23701484 0.84 CACNA1B (0.36) ALDH1A1MAPT
SCHEMBL27402318 0.82 GPR119 (0.34) GPR119
SCHEMBL27402350 0.82 GPR119 (0.34) GPR119
SCHEMBL23701406 0.79 ALDH1A1 (0.38) ALDH1A1MAPT
SCHEMBL23701408 0.79 ALDH1A1 (0.38) ALDH1A1MAPT
SCHEMBL23701446 0.77 ALDH1A1 (0.41) ALDH1A1MAPT
SCHEMBL23701447 0.77 ALDH1A1 (0.41) ALDH1A1MAPT
SCHEMBL20511076 0.77 GPR119 (0.67) GPR119NR1H2PDE10AALDH1A1LMNA
SCHEMBL27399965 0.77 GPR119 (0.67) GPR119NR1H2PDE10AALDH1A1LMNA

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-12018029-B2 Hexahydropyrrolo[3,4-c]pyrrole derivatives useful as LOX inhibitors THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-06-25 US disclosed
US-20210238179-A1 HEXAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES USEFUL AS LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-08-05 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-12018029-B2 Hexahydropyrrolo[3,4-c]pyrrole derivatives useful as LOX inhibitors LOX, LOXL1, LOXL3 GPR119 2107/4885JAK2 510/4885JAK1 1019/4885
US-20210238179-A1 HEXAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES USEFUL AS LOX INHIBITORS LOX, LOXL1, LOXL3 GPR119 2107/4885JAK2 510/4885JAK1 1019/4885

“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.