SCHEMBL4142005

SCHEMBL4142005

CC(=O)C[C@H](NC(=O)O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
ALDH1A1 P00352 4/20 0.48
MAPT P10636 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 2/20 0.48
POLB P06746 1/20 0.45
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
RIPK1 Q13546 1/20 0.44
CYP26A1 O43174 1/20 0.44
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL10962850 1.00 KMT2A (0.51) KMT2AALDH1A1MAPTL3MBTL1LMNA
SCHEMBL4628700 0.89 KMT2A (0.58) KMT2AALDH1A1MAPTL3MBTL1LMNA
SCHEMBL1709762 0.89 KMT2A (0.58) KMT2AALDH1A1MAPTL3MBTL1LMNA
SCHEMBL4628706 0.89 KMT2A (0.58) KMT2AALDH1A1MAPTL3MBTL1LMNA
SCHEMBL18117406 0.84 ALDH1A1 (0.48) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL890199 0.84 ALDH1A1 (0.48) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL890212 0.84 ALDH1A1 (0.48) KMT2AALDH1A1MAPTL3MBTL1MEN1
SCHEMBL27553133 0.84 MEN1 (0.66) KMT2AMAPTLMNASMN1; SMN2MEN1
SCHEMBL24115263 0.83 ALDH1A1 (0.57) KMT2AALDH1A1MAPTLMNAMEN1
SCHEMBL13593226 0.83 ALDH1A1 (0.57) KMT2AALDH1A1MAPTLMNAMEN1

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
US-20090209578-A1 CHEMICAL COMPOUNDS PFIZER INC 2009-08-20 US disclosed
EP-1963303-A2 CHEMICAL COMPOUNDS Pfizer Limited (GB) 2008-09-03 EP disclosed
WO-2007066201-A2 CHEMICAL COMPOUNDS PFIZER LIMITED (GB) 2007-06-14 WO 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-20090209578-A1 CHEMICAL COMPOUNDS CCR5, CXCR3, CXCR1 KMT2A 3350/4885ALDH1A1 1442/4885MAPT 4495/4885

“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.