SCHEMBL7090146

SCHEMBL7090146

Cc1cc(Cl)cc(C(O)C(=O)c2cccc(-c3ccc(F)cc3)c2-c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
MDM2 Q00987 2/20 0.36
SHMT1 P34896 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
MAPT P10636 1/20 0.35
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
CHRM1 P11229 1/20 0.35
HNF4A P41235 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
ACLY P53396 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
HMGCR P04035 1/20 0.34
PPARG P37231 3/20 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
SCHEMBL7089418 0.83 AKR1C3 (0.42) SLC6A4SLC6A3HTTMAPT
SCHEMBL7084405 0.81 ALDH1A1 (0.42) SLC6A4SLC6A3MAPTFABP3FABP4
SCHEMBL7743744 0.80 CES2 (0.39) SLC6A4SLC6A3HTTMAPT
SCHEMBL7085446 0.80 SLC6A4 (0.40) SLC6A4SLC6A3SHMT1HTTL3MBTL1
SCHEMBL7084396 0.78 PTGS2 (0.53)
SCHEMBL7089475 0.77 AKR1C3 (0.33) SLC6A4SLC6A3HTTL3MBTL1MAPT
SCHEMBL7091319 0.75 TTR (0.34) L3MBTL1MAPTFABP3FABP4HNF4A
SCHEMBL7085178 0.71 PTGER2 (0.38) SLC6A4SLC6A3MAPTCHRM1
SCHEMBL30370009 0.69 BCAT2 (0.57) SLC6A4SLC6A3HTTKEAP1NFE2L2
SCHEMBL7089414 0.68 PTGER2 (0.39) SLC6A4SLC6A3MAPT

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
US-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation G.D. SEARLE & CO. 2003-03-13 US disclosed
EP-0772601-B1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-09-18 EP disclosed
US-6426360-B1 ANTIARTHRITIC AGENTS G D SEARLE & CO. 2002-07-30 US disclosed
WO-1996003387-A1 4,5-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 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-20030050330-A1 4,5-subtstituted imdazolyl compounds for the treatment of inflammation AHR, HACL2, IRAK2 SLC6A4 2737/4885SLC6A3 3343/4885MDM2 3460/4885

“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.