SCHEMBL10172803

SCHEMBL10172803

CC1CCC(C(=O)OCCCS(=O)(=O)O)CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
APP P05067 1/20 0.31
KCNH2 Q12809 2/20 0.30
MAPT P10636 2/20 0.30
GAA P10253 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
SCHEMBL17297295 0.87 TP53 (0.42) ALDH1A1POLBKMT2ANPC1RAB9A
SCHEMBL10172800 0.85 APP (0.31) APP
SCHEMBL17297296 0.85 PLG (0.35) ALDH1A1MEN1KMT2AAPPGAA
SCHEMBL10172801 0.85 ALDH1A1 (0.37) ALDH1A1POLBAPPMAPT
SCHEMBL10172811 0.83 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMAPT
SCHEMBL18775925 0.81 KMT2A (0.33) ALDH1A1POLBMEN1KMT2AMAPT
SCHEMBL10172843 0.81 APP (0.31) APPKCNH2
SCHEMBL6402662 0.80 MAPT (0.38) ALDH1A1POLBMAPT
SCHEMBL10172846 0.80 ALDH1A1 (0.36) ALDH1A1APPMAPT
SCHEMBL15691940 0.80 ALDH1A1 (0.45) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9200098-B2 Radiation-sensitive composition and compound JSR CORPORATION (JP) 2015-12-01 US disclosed
US-20120164582-A1 RADIATION-SENSITIVE COMPOSITION AND COMPOUND JSR CORPORATION (JP) 2012-06-28 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-20120164582-A1 RADIATION-SENSITIVE COMPOSITION AND COMPOUND RAD51, RER1, ATP6AP1 ALDH1A1 1300/4885POLB 270/4885MEN1 48/4885

“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.