SCHEMBL864222

SCHEMBL864222

CCCCCCC1CC(CO)C(=O)O1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 1/20 0.54
LMNA P02545 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP1A2 P05177 2/20 0.49

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
SCHEMBL8095290 0.98 HTT (0.52) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL3658650 0.88 HTT (0.62) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL3656048 0.88 HTT (0.59) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL9673101 0.87 HTT (0.61) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL9673119 0.87 HTT (0.61) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL9673095 0.87 HTT (0.61) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL3657694 0.86 HTT (0.59) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL3657063 0.86 HTT (0.56) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL9450633 0.85 HTT (0.58) HTTSMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL6237053 0.81 ALDH1A1 (0.52) HTTSMN1; SMN2ALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077126-A1 Fluorine-Containing Compound, Fluorine-Containing Polymer Compound, Resist Composition, Top Coat Composition And Pattern Formation Method CENTRAL GLASS COMPANY, LIMITED (JP) 2012-03-29 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 (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-20120077126-A1 Fluorine-Containing Compound, Fluorine-Containing Polymer Compound, Resist Composition, Top Coat Composition And Pattern Formation Method FRG1, AFF2, FBXL19 HTT 2917/4885SMN1; SMN2 3403/4885ALDH1A1 4430/4885

“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.