SCHEMBL3093436

SCHEMBL3093436

CC(C)c1ccc(Cc2cccc3[c]cn(C)c23)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 2/20 0.33
SLC5A1 P13866 1/20 0.33
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
IDO1 P14902 2/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
CASR P41180 2/20 0.30
PNP P00491 1/20 0.30

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
SCHEMBL3091829 0.84 POLB (0.33)
SCHEMBL3090081 0.84 TP53 (0.31) SLC5A2
SCHEMBL3084727 0.81 SLC6A4 (0.46) SLC5A2SLC5A1
SCHEMBL3093428 0.72 SLC5A2 (0.35) SLC5A2SLC5A1HTR1DHTR1BIDO1
SCHEMBL3084929 0.71 SLC5A2 (0.34) SLC5A2SLC5A1HTR1DHTR1BIDO1
SCHEMBL3091180 0.70 PNP (0.38) SLC5A2SLC5A1HTR1DHTR1BIDO1
SCHEMBL8637440 0.70 IDO1 (0.42) SLC5A2SLC5A1HTR1DHTR1BIDO1
SCHEMBL7300578 0.68 ALKBH5 (0.37) ACHE
SCHEMBL3074353 0.67 SLC5A2 (0.34) SLC5A2SLC5A1HTR1DHTR1BIDO1
SCHEMBL3090873 0.67 SLC5A2 (0.34) SLC5A2SLC5A1HTR1DHTR1BIDO1

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-8207134-B2 Fused ring spiroketal derivative and use thereof as anti-diabetic drug CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-06-26 US disclosed
US-20100234609-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS ANTI-DIABETIC DRUG CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-09-16 US disclosed
EP-2048152-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS DRUG FOR TREATING DIABETES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-04-15 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 (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-20100234609-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS ANTI-DIABETIC DRUG REN, WNK1, GCKR SLC5A2 19/4885SLC5A1 16/4885HTR1D 3370/4885

“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.