SCHEMBL9891004

SCHEMBL9891004

CCOC(=O)C(C)(CC)CCC1CCN(C(=O)Cl)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
THRB P10828 1/20 0.37
ATM Q13315 1/20 0.37
NOS3 P29474 1/20 0.35
NOS2 P35228 1/20 0.35
ALDH1A1 P00352 5/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 2/20 0.35
CHRM1 P11229 1/20 0.35
FKBP1A P62942 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL9891006 0.85 HPGD (0.44) GAAALDH1A1MEN1KMT2ATSHR
SCHEMBL9890999 0.79 CYP4F2 (0.35) GAATHRBHTTFKBP1AMEN1
SCHEMBL9891008 0.79 GNAI3 (0.36) THRBMAPTMEN1KMT2A
SCHEMBL9891000 0.77 SMYD3 (0.37) GAATHRBNOS3NOS2HTT
SCHEMBL9891012 0.73 KDM4E (0.36)
SCHEMBL15247425 0.73 HPGD (0.45) GAASMN1; SMN2
SCHEMBL6750166 0.73 HPGD (0.45) GAASMN1; SMN2
SCHEMBL9389313 0.72 HPGD (0.44) GAAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL9212728 0.71 GAA (0.53) GAAL3MBTL1THRBATMNOS3
SCHEMBL15247133 0.70 GNAI3 (0.32) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142722-A1 CONJUGATES OF CYTOTOXIC DRUGS APOSENSE LTD. (IL) 2012-06-07 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-20120142722-A1 CONJUGATES OF CYTOTOXIC DRUGS CD47, MCL1, BAD GAA 144/4885L3MBTL1 1002/4885THRB 4364/4885

“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.