SCHEMBL23701443

SCHEMBL23701443

CN(C)CCCN(C)c1ccc(N2CC3CN(CCCC#N)CC3C2)cc1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 14/20 0.37
TMEM97 Q5BJF2 3/20 0.37
HRH3 Q9Y5N1 4/20 0.33
NMT1 P30419 1/20 0.31

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
SCHEMBL23701444 1.00 HTR7 (0.37) HTR7TMEM97HRH3NMT1
SCHEMBL27400155 0.89 HTR7 (0.33) HTR7TMEM97
SCHEMBL27399973 0.79 HTR7 (0.46) HTR7TMEM97HRH3
SCHEMBL23701484 0.74 CACNA1B (0.36) HTR7
SCHEMBL23701485 0.74 ACACB (0.44) HTR7TMEM97HRH3
SCHEMBL23701487 0.74 ACACB (0.44) HTR7TMEM97HRH3
SCHEMBL23701422 0.73 KDM4E (0.42) HTR7TMEM97
SCHEMBL23701421 0.73 KDM4E (0.42) HTR7TMEM97
SCHEMBL23701401 0.71 HRH3 (0.35) HTR7TMEM97HRH3
SCHEMBL23701405 0.71 KDM4E (0.40) HTR7TMEM97HRH3

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 HTR7 2686/4885TMEM97 2345/4885HRH3 523/4885
US-20210238179-A1 HEXAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES USEFUL AS LOX INHIBITORS LOX, LOXL1, LOXL3 HTR7 2686/4885TMEM97 2345/4885HRH3 523/4885

“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.