SCHEMBL26316726

SCHEMBL26316726

Cc1ccc(-c2ccc(COc3ccc(CCCCn4ccnn4)cc3)cn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.46
MAPT P10636 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ERBB2 P04626 1/20 0.43
MINK1 Q8N4C8 1/20 0.43
ATP4A P20648 1/20 0.43
ATP4B P51164 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
NPC1 O15118 6/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
ATM Q13315 2/20 0.39
STAT3 P40763 1/20 0.39
CYP11B1 P15538 1/20 0.38
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL4600213 0.90 ERBB2 (0.43) RAB9AMAPTL3MBTL1ERBB2MINK1
SCHEMBL5005698 0.87 ERBB2 (0.58) RAB9AMAPTL3MBTL1ERBB2MINK1
SCHEMBL26316675 0.82 ERBB2 (0.58) RAB9AERBB2MINK1ATP4AATP4B
SCHEMBL4599923 0.81 ATP4A (0.37) RAB9AMAPTL3MBTL1ERBB2MINK1
SCHEMBL4599702 0.80 ERBB2 (0.51) ERBB2MINK1ATP4AATP4BCYP11B1
SCHEMBL26316556 0.80 HRH1 (0.47) RAB9AERBB2MINK1NPC1ATM
SCHEMBL4600099 0.79 ERBB2 (0.38) RAB9AMAPTL3MBTL1ERBB2MINK1
SCHEMBL4599907 0.79 ERBB2 (0.46) RAB9AMAPTL3MBTL1ERBB2MINK1
SCHEMBL6582554 0.78 HMOX1 (0.53) RAB9AMAPTERBB2MINK1ATP4A
SCHEMBL4599664 0.78 ERBB2 (0.44) RAB9AMAPTL3MBTL1ERBB2MINK1

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-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF UNIV MONTREAL (CA) 2023-11-09 US disclosed
US-11760754-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof Université de Montréal (CA) 2023-09-19 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-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF IDH2, TFAM, IDH1 RAB9A 2806/4885MAPT 4580/4885L3MBTL1 2679/4885
US-11760754-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof IDH2, TFAM, NUTF2 RAB9A 2786/4885MAPT 4527/4885L3MBTL1 2246/4885

“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.