SCHEMBL4367299

SCHEMBL4367299

CC[C@@H](N)CNc1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.55
GAA P10253 8/20 0.55
ALDH1A1 P00352 6/20 0.50
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
MAPK1 P28482 2/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
THRB P10828 1/20 0.45
RECQL P46063 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
NR4A1 P22736 1/20 0.43
CA12 O43570 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
SCHEMBL4367293 1.00 MAPT (0.55) MAPTGAAALDH1A1KMT2AMEN1
SCHEMBL3011500 0.81 MAPT (0.59) MAPTGAAALDH1A1KMT2AMEN1
SCHEMBL15145999 0.81 MAPT (0.50) MAPTGAAALDH1A1KMT2AMEN1
SCHEMBL13624256 0.78 MEN1 (0.47) MAPTGAAALDH1A1KMT2AMEN1
SCHEMBL10847698 0.77 FNTA (0.53) MAPTALDH1A1HTTSMN1; SMN2
SCHEMBL16671107 0.77 MAPT (0.63) MAPTGAAALDH1A1KMT2AMEN1
SCHEMBL13624261 0.77 LTA4H (0.54) MAPTGAAALDH1A1KMT2AMEN1
SCHEMBL4371654 0.76 TAS1R3 (0.50) MAPTGAAALDH1A1KMT2AMAPK1
SCHEMBL4371657 0.76 TAS1R3 (0.50) MAPTGAAALDH1A1KMT2AMAPK1
SCHEMBL18235938 0.76 GAA (0.67) MAPTGAAALDH1A1KMT2AMEN1

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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS CTSE, SPINT2, CTSF MAPT 480/4885GAA 2184/4885ALDH1A1 2506/4885

“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.