SCHEMBL3149166

SCHEMBL3149166

[CH2]COCc1cc(F)cc(F)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.54
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
TACR1 P25103 1/20 0.36
AGXT P21549 2/20 0.33
GSK3B P49841 2/20 0.33
BACE1 P56817 2/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP12 P39900 1/20 0.33
MAOB P27338 1/20 0.31
ACHE P22303 1/20 0.31
DHFR P00374 1/20 0.31
DCPS Q96C86 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
SCHEMBL5781149 0.82 IDO1 (0.50) IDO1CA12CA1CA9TACR1
SCHEMBL2093705 0.79 IDO1 (0.60) IDO1AGXTMAOB
SCHEMBL5979496 0.79 IDO1 (0.47) IDO1CA12CA1CA9TACR1
SCHEMBL5977204 0.77 IDO1 (0.40) IDO1
SCHEMBL883828 0.76 IDO1 (0.54) IDO1AGXTMAOB
SCHEMBL15573480 0.76 IDO1 (0.54) IDO1CA12CA1CA9TACR1
SCHEMBL28297736 0.76 IDO1 (0.54) IDO1CA12CA1CA9TACR1
SCHEMBL4798547 0.75 IDO1 (0.58) IDO1CA12CA1CA9TACR1
SCHEMBL13349758 0.73 IDO1 (0.50) IDO1CA12CA1CA9TACR1
SCHEMBL3155758 0.71 IDO1 (0.52) IDO1TACR1AGXTMAOB

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-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed
EP-2061789-A2 THIADIAZOLE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2009-05-27 EP disclosed
WO-2008032858-A2 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-20 WO disclosed
US-7015345-B2 Propionic acid derivatives ASAHI KASEI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1484316-A1 NOVEL PROPIONIC ACID DERIVATIVE Asahi Kasei Pharma Corporation (JP) 2004-12-08 EP disclosed
US-20040072690-A1 Novel propionic acid derivatives ASAHI KASEI PHARMA CORPORATION (JP) 2004-04-15 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-20040072690-A1 Novel propionic acid derivatives PNLIP, LIPC, GPR119 IDO1 4434/4885CA12 2779/4885CA1 2835/4885
US-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF NR2C2, NR4A3, NR0B2 IDO1 1716/4885CA12 4570/4885CA1 4105/4885

“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.