SCHEMBL11977166

SCHEMBL11977166

Cc1cccc(C)c1CN1CCc2ccc(C(=O)O)cc21

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 10/20 0.70
ACHE P22303 1/20 0.45
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
MYC P01106 1/20 0.42
GAA P10253 1/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42

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
SCHEMBL11976869 0.86 SLC22A12 (0.63) SLC22A12ACHEALDH1A1MAPTTSHR
SCHEMBL11975007 0.82 SLC22A12 (1.00) SLC22A12ACHEMAPTHDAC1HDAC6
SCHEMBL6177893 0.81 ACHE (0.63) SLC22A12ACHEALDH1A1MAPTHDAC1
SCHEMBL5404613 0.79 ACHE (0.46) SLC22A12ACHEALDH1A1MAPTMYC
Potassium Ion SCHEMBL15400487 0.79 SLC22A12 (0.80) SLC22A12ACHEHDAC1HDAC6
SCHEMBL11977154 0.77 SLC22A12 (0.77) SLC22A12ALDH1A1MAPTTSHRGAA
SCHEMBL11975009 0.75 SLC22A12 (0.67) SLC22A12TSHRHDAC1HDAC6
SCHEMBL3349545 0.75 ACHE (0.47) SLC22A12ACHEALDH1A1MAPTGAA
SCHEMBL28447449 0.74 MEN1 (0.46) SLC22A12ACHEALDH1A1MAPTMYC
SCHEMBL5134560 0.73 LMNA (0.50) ACHEHDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9359350-B2 Ring-fused compound SATO PHARMACEUTICAL CO., LTD. (JP) 2016-06-07 US disclosed
US-9359350-B2 Ring-fused compound SATO PHARMACEUTICAL CO., LTD. (JP) 2016-06-07 US disclosed
US-20150203490-A1 RING-FUSED COMPOUND SATO PHARMACEUTICAL CO., LTD. (JP) 2015-07-23 US disclosed
US-20150203490-A1 RING-FUSED COMPOUND SATO PHARMACEUTICAL CO., LTD. (JP) 2015-07-23 US disclosed
US-8987473-B2 Ring-fused compound SATO PHARMACEUTICAL CO., LTD. (JP) 2015-03-24 US disclosed
US-8987473-B2 Ring-fused compound SATO PHARMACEUTICAL CO., LTD. (JP) 2015-03-24 US disclosed
WO-2012102405-A1 RING-FUSED COMPOUND 佐藤製薬株式会社 (JP) 2012-08-02 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-20150203490-A1 RING-FUSED COMPOUND URB2, RCOR1, RCC2 SLC22A12 394/4885ACHE 3840/4885ALDH1A1 487/4885

“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.