SCHEMBL6804289

SCHEMBL6804289

NC(=O)CCc1cc(Cl)sc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.43
DAO P14920 2/20 0.42
PLA2G10 O15496 1/20 0.37
MPO P05164 2/20 0.36
F2 P00734 1/20 0.35
MTNR1A P48039 1/20 0.35
CAPN1 P07384 1/20 0.34
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATM Q13315 1/20 0.33
RAB9A P51151 2/20 0.33
KMT2A Q03164 1/20 0.33
PLAU P00749 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL25263028 0.91 GSK3B (0.42) GSK3BDAOPLA2G10MPOF2
SCHEMBL6803626 0.82 NPSR1 (0.48) GSK3BDAOPLAU
SCHEMBL23111601 0.82 GSK3B (0.44) GSK3BDAOPLA2G10MAPTKDM4E
SCHEMBL6804584 0.81 GSK3B (0.43) GSK3BDAOMAPTKDM4EHPGD
SCHEMBL25307831 0.80 GSK3B (0.46) GSK3BDAOPLA2G10F2MAPT
SCHEMBL6804241 0.77 GSK3B (0.40) GSK3BDAOMAPTKDM4EHPGD
SCHEMBL31026897 0.76 GSK3B (0.40) GSK3BDAOPLA2G10MTNR1AMAPT
SCHEMBL6798230 0.76 F13A1 (0.47) GSK3BDAOKMT2AMAPK1HTT
SCHEMBL25306516 0.74 TSHR (0.41) GSK3BDAOMPOMAPTKDM4E
SCHEMBL6798412 0.74 CYP4F2 (0.50) GSK3BDAOMAPTKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142976-A1 Pyridylfuran and pyridylthiophene compounds PFIZER INC. 2004-07-22 US disclosed
US-6696470-B2 FOR THERAPY OF ARTHRITIS, ASTHMA, BONE RESORPTION DISEASE, CACHEXIA, CARDIOVASCULAR DISEASE, CEREBRAL MALARIA, CROHN'S DISEASE, DIABETES, FEVER OR MYALGIA DUE TO INFECTION, GOUT, GRAFT VERSUS HOST REACTION, INFLAMMATION OF ORGANS, ETC. PFIZER INC. 2004-02-24 US disclosed
US-20020022729-A1 Pyridylfuran and pyridylthiophene compounds KAWAI AKIYOSHI (JP) 2002-02-21 US disclosed
EP-0853083-B1 Pyridylfuran and pyridylthiophene compounds and pharmaceutical use thereof PFIZER (US) 2001-09-12 EP disclosed
US-6048880-A THERAPY FOR CYTOKINE SENSITIVE DISEASES PFIZER PHARAMACEUTICALS INC. (JP) 2000-04-11 US disclosed
EP-0853083-A1 Pyridylfuran and pyridylthiophene compounds and pharmaceutical use thereof PFIZER INC. (US) 1998-07-15 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 (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-20040142976-A1 Pyridylfuran and pyridylthiophene compounds MC2R, FCGR2A, OGFR GSK3B 3059/4885DAO 896/4885PLA2G10 3950/4885
US-20020022729-A1 Pyridylfuran and pyridylthiophene compounds MC2R, CRHR1, NR3C2 GSK3B 3045/4885DAO 940/4885PLA2G10 3692/4885

“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.