SCHEMBL4924328

SCHEMBL4924328

C#Cc1cccc2c1c(Cl)c(C(=O)OCC)n2-c1ccc(OC2CCCC2)cc1.c1cc2cc-2c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
FAAH O00519 5/20 0.34
MGLL Q99685 1/20 0.34
HTT P42858 2/20 0.34
TP53 P04637 2/20 0.34
POLB P06746 1/20 0.34
CASP3 P42574 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KCNH2 Q12809 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL4914773 0.88 PDE4A (0.36) HRH3FAAHKCNH2PDE4APDE4B
SCHEMBL3567412 0.76 MAPT (0.42) MAOAMAOBTP53CASP3ALDH1A1
SCHEMBL3577723 0.76 MAOA (0.39) MAOAMAOBHTTTP53POLB
SCHEMBL4922812 0.75 THRB (0.41) MAOAMAOBTP53ALDH1A1MAPT
SCHEMBL3575302 0.74 THRB (0.39) MAOAMAOBHRH3HTTTP53
SCHEMBL3570481 0.72 UCHL1 (0.39) MAOAMAOBHTTTP53POLB
SCHEMBL3573660 0.71 FAAH (0.40) MAOAMAOBHRH3FAAHKCNH2
SCHEMBL4918631 0.71 EPHX2 (0.47) FAAHPDE4BPDE4D
SCHEMBL3569793 0.69 GCK (0.40) FAAHKCNH2MAPTTHRBSMN1; SMN2
SCHEMBL333883 0.67 FAAH (0.38) MAOAMAOBFAAHALDH1A1PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249091-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-10-09 US disclosed
EP-1844013-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-17 EP disclosed
WO-2006077364-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO 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-20080249091-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, ARG1 MAOA 142/4885MAOB 226/4885HRH3 104/4885

“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.