SCHEMBL27101124

SCHEMBL27101124

Cc1cc(C(=O)Nc2cccc(CN3CCCCC3)c2)ccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 16/20 0.60
▸ USP7 Q93009 1/20 0.59
▸ RAB9A P51151 2/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ GAA P10253 1/20 0.55
▸ HTT P42858 1/20 0.55

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
SCHEMBL27101127 0.89 GAA (0.65) RAB9AKDM4EALDH1A1MAPTGAA
SCHEMBL17270179 0.85 ACKR3 (0.74) ACKR3USP7RAB9AKDM4EALDH1A1
SCHEMBL2461162 0.81 USP7 (0.62) ACKR3USP7RAB9AKDM4EALDH1A1
SCHEMBL17270212 0.79 ACKR3 (0.73) ACKR3RAB9AKDM4EALDH1A1MAPT
SCHEMBL17270139 0.78 ACKR3 (0.80) ACKR3
SCHEMBL7600247 0.77 KDM4E (0.69) ACKR3KDM4EALDH1A1MAPTGAA
SCHEMBL2460203 0.76 USP7 (0.57) ACKR3USP7RAB9AKDM4EALDH1A1
SCHEMBL2989277 0.76 RAB9A (0.78) RAB9AKDM4EALDH1A1MAPTGAA
SCHEMBL10702311 0.76 KDM4E (0.67) ACKR3KDM4EALDH1A1MAPTGAA
SCHEMBL24124175 0.76 USP7 (0.52) ACKR3USP7RAB9AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067600-A1 SMALL MOLECULE INHIBITORS OF THE MITOCHONDRIAL PERMEABILITY TRANSITION PORE (mtPTP) UNIVERSITY OF KANSAS (US) 2024-02-29 — — 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-20240067600-A1 SMALL MOLECULE INHIBITORS OF THE MITOCHONDRIAL PERMEABILITY TRANSITION PORE (mtPTP) MTCH2, TIMM50, TIMM10 ACKR3 4806/4885USP7 3472/4885RAB9A 1640/4885

“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.

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