SCHEMBL3264041

SCHEMBL3264041

CCC(CC(=O)OC)Nc1cc(Cl)cc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HTT P42858 2/20 0.37
ALDH1A1 P00352 5/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
POLB P06746 1/20 0.36
TNF P01375 2/20 0.36
GAA P10253 2/20 0.35
DHODH Q02127 1/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL8996137 1.00 L3MBTL1 (0.49) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL3264038 1.00 L3MBTL1 (0.49) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL3263015 0.84 HTT (0.47) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL3263011 0.84 HTT (0.47) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL8996243 0.84 HTT (0.47) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL8996235 0.83 HTT (0.38) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL8996290 0.83 HTT (0.38) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL8996387 0.82 L3MBTL1 (0.41) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL8996383 0.82 L3MBTL1 (0.41) L3MBTL1MAPTMEN1KMT2AHTT
SCHEMBL14969758 0.81 MEN1 (0.39) L3MBTL1MAPTMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594843-B1 METHOD FOR PRODUCING AN OPTICALLY ACTIVE beta-amino acid derivative TAKASAGO PERFUMERY CO LTD (JP) 2013-05-22 EP disclosed
US-8188307-B2 Method for producing an optically active tetrahydroquinoline TAKASAGO INTERNATIONAL CORPORATION (JP) 2012-05-29 US disclosed
US-20100036149-A1 METHOD FOR PRODUCING AN OPTICALLY ACTIVE TETRAHYDROQUINOLINE TAKASAGO INTERNATIONAL COPORATION (JP) 2010-02-11 US disclosed
US-7601842-B2 Method for producing an optically active tetrahydroquinoline TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-13 US disclosed
US-20060122225-A1 Method for producing an optically active tetrahydroquinoline TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-06-08 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-20100036149-A1 METHOD FOR PRODUCING AN OPTICALLY ACTIVE TETRAHYDROQUINOLINE AADAT, KMO, ALDH7A1 L3MBTL1 4666/4885MAPT 4178/4885MEN1 1376/4885
US-20060122225-A1 Method for producing an optically active tetrahydroquinoline AADAT, KMO, ALDH7A1 L3MBTL1 4666/4885MAPT 4178/4885MEN1 1376/4885

“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.