SCHEMBL10109761

SCHEMBL10109761

CC(C)(C)CC1C(=O)Nc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 7/20 0.58
MAPT P10636 4/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 1/20 0.56
GAA P10253 1/20 0.56
GSK3B P49841 2/20 0.53
TDO2 P48775 2/20 0.50
BRPF1 P55201 1/20 0.44
CREBBP Q92793 1/20 0.44
ALDH1A1 P00352 1/20 0.42
HTR7 P34969 1/20 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
SCHEMBL8494132 0.87 IDO1 (0.55) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL24863639 0.87 IDO1 (0.55) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL2693278 0.80 IDO1 (0.64) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL8494184 0.79 IDO1 (0.48) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL14256464 0.79 IDO1 (0.54) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL1542794 0.78 IDO1 (0.77) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL7041168 0.77 IDO1 (0.70) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL9159527 0.77 IDO1 (0.64) IDO1MAPTL3MBTL1KDM4EGAA
Hydrochloric Acid SCHEMBL7419440 0.77 IDO1 (0.74) IDO1MAPTL3MBTL1KDM4EGAA
SCHEMBL1461848 0.77 IDO1 (0.64) IDO1MAPTL3MBTL1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016133217-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE OXINDOLE COMPOUND AND TRIAZOLIUM SALT USED THEREIN AS CATALYST 国立大学法人名古屋大学 2016-08-25 WO disclosed
US-20150291658-A1 NOVEL CHONDRAMIDE DERIVATIVES HELMOLTZ-ZENTRUM FÜR INFEKTIONSFORSCHUNG (DE) 2015-10-15 US disclosed
US-20120053181-A1 PYRROLIDINE-DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS MERCK SHARP & DOHME, CORP. (US) 2012-03-01 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 (2 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-20150291658-A1 NOVEL CHONDRAMIDE DERIVATIVES CFAP410, CNN2, CSGALNACT1 IDO1 1142/4885MAPT 4398/4885L3MBTL1 4008/4885
US-20120053181-A1 PYRROLIDINE-DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS ADRB3, ADRB1, ADRB2 IDO1 1190/4885MAPT 2633/4885L3MBTL1 4385/4885

“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.