SCHEMBL7035015

SCHEMBL7035015

OC=C(CCO)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC3 O15379 1/20 0.44
NCOR2 Q9Y618 1/20 0.44
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
POLB P06746 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
NR4A2 P43354 1/20 0.35
KMT2A Q03164 1/20 0.35
PDPK1 O15530 2/20 0.35

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
SCHEMBL7035013 1.00 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6438252 0.82 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6438249 0.82 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL6438248 0.82 HDAC1 (0.44) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL24376117 0.81 HDAC1 (0.57) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL11527446 0.80 HDAC1 (0.42) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL11527443 0.80 HDAC1 (0.42) HDAC1HDAC2HDAC3NCOR2MAOA
Hydrochloric Acid SCHEMBL2473896 0.79 HDAC1 (0.55) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL24593486 0.78 HDAC1 (0.41) HDAC1HDAC2HDAC3NCOR2MAOA
SCHEMBL7462866 0.78 MTNR1A (0.50) HDAC1HDAC2HDAC3NCOR2

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-20030065117-A1 Modified silicone compound, process of producing the same, and cured object obtained therefrom NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2003-04-03 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-20030065117-A1 Modified silicone compound, process of producing the same, and cured object obtained therefrom ORMDL3, SGMS1, HEATR1 HDAC1 752/4885HDAC2 951/4885HDAC3 2453/4885

“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.