SCHEMBL2961235

SCHEMBL2961235

O=C1CCc2cc(C(=O)c3ccc(OC4CCCC4)cc3O)ccc2O1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JUN P05412 1/20 0.43
UGT1A1 P22309 1/20 0.43
UGT1A3 P35503 1/20 0.43
UGT1A8 Q9HAW9 1/20 0.43
MAOB P27338 3/20 0.38
ACSL1 P33121 1/20 0.37
PARP10 Q53GL7 1/20 0.36
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.35
CYP1A2 P05177 1/20 0.34
PGR P06401 1/20 0.34
CYP2D6 P10635 1/20 0.34
HPGD P15428 1/20 0.34
SLC6A2 P23975 1/20 0.34
PDE4A P27815 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL2959650 0.87 MEN1 (0.35) JUNUGT1A1UGT1A3UGT1A8MAOB
SCHEMBL2957000 0.82 MEN1 (0.47) MAOBLMNAALDH1A1NPC1SMN1; SMN2
SCHEMBL1100519 0.76 MAOB (0.50) JUNUGT1A1UGT1A3UGT1A8MAOB
SCHEMBL2965162 0.74 PTGS2 (0.42) MAOBALDH1A1NPC1SMN1; SMN2MAPT
SCHEMBL9002504 0.74 HPGD (0.59) JUNUGT1A1UGT1A3UGT1A8MAOB
SCHEMBL1100077 0.73 PARP10 (0.43) JUNUGT1A1UGT1A3UGT1A8MAOB
SCHEMBL2968672 0.73 PTGS2 (0.36) MAOBLMNAALDH1A1NPC1RAB9A
SCHEMBL2967202 0.71 MAOB (0.36) MAOBLMNAALDH1A1NPC1RAB9A
SCHEMBL12316318 0.69 PARP10 (0.55) MAOBPARP10ALDH1A1NPC1RAB9A
SCHEMBL1376229 0.69 MAOB (0.56) MAOBPARP10ALDH1A1MAPTMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
US-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SHUNICHI SHIOZAWA (JP) 2005-05-26 US disclosed
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 EP 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-20050113400-A1 Inhibitors of transcription factor AP-1; autoimmune diseases; rheumatoid arthritis; high safety and excellent pharmacokinetics in vivo SP1, AP1G1, JUN JUN 3/4885UGT1A1 1244/4885UGT1A3 2640/4885

“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.