SCHEMBL26316671

SCHEMBL26316671

Cc1ccc(/C=C/c2cccc(COc3ccc(CCCCn4ccnn4)cc3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.53
MINK1 Q8N4C8 1/20 0.53
LCK P06239 1/20 0.42
FFAR1 O14842 2/20 0.38
MAOA P21397 4/20 0.37
MAOB P27338 4/20 0.37
AKR1C3 P42330 1/20 0.36
PTPN1 P18031 1/20 0.36
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
ATP4A P20648 1/20 0.35
ATP4B P51164 1/20 0.35

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
SCHEMBL26316675 0.91 ERBB2 (0.58) ERBB2MINK1LCKMAOBPTPN1
SCHEMBL24111989 0.88 ERBB2 (0.68) ERBB2MINK1LCKFFAR1MAOA
SCHEMBL28470380 0.88 ERBB2 (0.68) ERBB2MINK1LCKFFAR1MAOA
SCHEMBL3668064 0.80 ERBB2 (0.80) ERBB2MINK1FFAR1NPC1CASP3
SCHEMBL3668068 0.80 ERBB2 (0.80) ERBB2MINK1FFAR1NPC1CASP3
SCHEMBL28476109 0.80 FFAR1 (0.50) ERBB2MINK1FFAR1MAOAMAOB
SCHEMBL28476298 0.80 MAOB (0.54) ERBB2MINK1MAOAMAOB
SCHEMBL28472414 0.80 MAOB (0.53) ERBB2MINK1MAOAMAOB
SCHEMBL6582554 0.79 HMOX1 (0.53) ERBB2MINK1FFAR1NPC1RAB9A
SCHEMBL26316653 0.79 ERBB2 (0.70) ERBB2MINK1FFAR1MAOAMAOB

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 ERBB2 2558/4885MINK1 1781/4885LCK 1618/4885
US-11760754-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof IDH2, TFAM, NUTF2 ERBB2 2443/4885MINK1 1986/4885LCK 1694/4885

“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.