SCHEMBL4255074

SCHEMBL4255074

COc1ccc(C(=O)CCCCl)c(OC)c1OC

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 11/20 0.53
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PKM P14618 1/20 0.41
TUBB1 Q9H4B7 2/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL22133207 0.86 HPGD (0.51) MEN1NPC1RAB9AKMT2AMAPT
SCHEMBL4128743 0.86 PDE4B (0.51) PDE4DMAPTTDP1LMNAMAPK1
SCHEMBL4126956 0.84 PDE4D (0.50) PDE4DMAPTTDP1LMNAMAPK1
SCHEMBL4120097 0.84 PDE4D (0.50) PDE4DMEN1NPC1RAB9AKMT2A
SCHEMBL8544960 0.83 PDE4D (0.58) PDE4DMEN1NPC1RAB9AKMT2A
SCHEMBL4131305 0.83 PDE4D (0.49) PDE4DMEN1NPC1RAB9AKMT2A
SCHEMBL10657187 0.81 THRB (0.50) PDE4DMEN1KMT2AMAPTLMNA
SCHEMBL4118586 0.81 HTT (0.53) PDE4DMEN1KMT2AMAPTTDP1
SCHEMBL11680967 0.81 PDE4D (0.52) PDE4DMEN1NPC1RAB9AKMT2A
SCHEMBL4133074 0.79 PDE4D (0.51) PDE4DMEN1NPC1RAB9AKMT2A

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-20090176802-A1 ANTIDOTES TO EXOGENOUS NEUROTOXIC AGENTS PAPADOPOULOS VASSILIOS 2009-07-09 US disclosed
US-20060247248-A1 Sigma-1 receptor ligand with acetylcholinesterase SAMARITAN PHARMACEUTICALS, INC. 2006-11-02 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-20060247248-A1 Sigma-1 receptor ligand with acetylcholinesterase SIGMAR1, CHRNE, ACHE PDE4D 2608/4885MEN1 4545/4885NPC1 694/4885
US-20090176802-A1 ANTIDOTES TO EXOGENOUS NEUROTOXIC AGENTS INA, ACHE, NLN PDE4D 2352/4885MEN1 2598/4885NPC1 1531/4885

“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.