SCHEMBL23701375

SCHEMBL23701375

CCOc1ccc(N2C[C@H]3CN(C(=O)N4CCC(F)(F)CC4)C[C@H]3C2)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 18/20 0.47
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL23701376 1.00 ACACB (0.47) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23732382 0.85 FKBP1A (0.57) ALDH1A1TP53MAPTMAPK1
SCHEMBL23701469 0.84 KMT2A (0.43) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701470 0.83 KMT2A (0.42) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701472 0.83 KMT2A (0.42) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701352 0.82 ALDH1A1 (0.49) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701353 0.82 ALDH1A1 (0.49) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701448 0.80 ALDH1A1 (0.45) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701449 0.80 ALDH1A1 (0.45) ACACBALDH1A1TP53MAPTPKM
SCHEMBL23701407 0.79 MAPT (0.48) ACACBALDH1A1TP53MAPTPKM

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
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-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-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
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 ACACB 4191/4885ALDH1A1 765/4885TP53 2472/4885
US-20210238179-A1 HEXAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES USEFUL AS LOX INHIBITORS LOX, LOXL1, LOXL3 ACACB 4191/4885ALDH1A1 765/4885TP53 2472/4885

“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.