SCHEMBL7064808

SCHEMBL7064808

COc1ccc(C(=O)OC(C)n2cc(C3=CC(=O)NC3=O)c3cc(OCc4ccccc4)ccc32)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK1 P28482 2/20 0.37
ABCB1 P08183 2/20 0.37
MAPT P10636 1/20 0.37
MMP1 P03956 2/20 0.37
SMPD1 P17405 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PLA2G4A P47712 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
PLA2G2A P14555 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 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
SCHEMBL6098654 0.84 NPC1 (0.41) NPC1HPGDRAB9ASMN1; SMN2MAPK1
SCHEMBL7064807 0.84 MAPK1 (0.45) NPC1HPGDRAB9ASMN1; SMN2MAPK1
SCHEMBL6098735 0.75 BAZ2B (0.48) NPC1RAB9APPARGPPARDPPARA
SCHEMBL6100670 0.74 MAOB (0.43) MAOAMAOB
SCHEMBL6098592 0.72 PPARD (0.48) PPARGPPARDPPARAPLA2G2AMAOA
SCHEMBL6097466 0.72 MAOB (0.44) NPC1RAB9APPARGPPARDPPARA
SCHEMBL6799799 0.72 PPARG (0.41) NPC1RAB9APPARGPPARDPPARA
SCHEMBL6098776 0.69 LTA4H (0.39) NPC1RAB9APPARGPPARDPPARA
SCHEMBL6099511 0.69 MAOB (0.41) NPC1RAB9APPARGPPARDPPARA
SCHEMBL6099154 0.69 HTR6 (0.52) NPC1RAB9AMMP1HDAC1HDAC6

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-20040102467-A1 Neuroprotective and anti-proliferative compounds AEGERA THERAPEUTICS INC. (CA) 2004-05-27 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-20040102467-A1 Neuroprotective and anti-proliferative compounds MKI67, NLN, BDNF NPC1 2589/4885HPGD 405/4885RAB9A 3429/4885

“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.