SCHEMBL4456099

SCHEMBL4456099

O=C(CNc1ccccc1)NC(CO)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 4/20 0.50
ERCC4 Q92889 4/20 0.50
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
MME P08473 2/20 0.47
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
GAA P10253 2/20 0.45
PKM P14618 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CA2 P00918 4/20 0.44
CA1 P00915 3/20 0.44
CA12 O43570 1/20 0.44
CA7 P43166 1/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
TGFBR1 P36897 1/20 0.42
DGAT1 O75907 1/20 0.41

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
SCHEMBL4456109 1.00 ERCC1 (0.50) ERCC1ERCC4FNTAFNTBMME
SCHEMBL13358894 0.87 FNTA (0.51) ERCC1ERCC4FNTAFNTBMME
SCHEMBL13358896 0.87 FNTA (0.51) ERCC1ERCC4FNTAFNTBMME
SCHEMBL7365767 0.85 MME (0.55) MMELMNA
SCHEMBL8074262 0.84 MAPK1 (0.54) MMEALDH1A1
SCHEMBL8074253 0.84 MAPK1 (0.54) MMEALDH1A1
SCHEMBL8429491 0.82 KMT2A (0.63) ERCC1ERCC4GAACA2CA1
SCHEMBL7449907 0.82 MME (0.50) ERCC1ERCC4MMEALDH1A1CA2
SCHEMBL8429586 0.82 KMT2A (0.63) ERCC1ERCC4GAACA2CA1
SCHEMBL6623667 0.79 PKM (0.49) ERCC1ERCC4MMEALDH1A1LMNA

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-20090005321-A1 Phenylazetidinone Derivatives MICROBIA, INC. (US) 2009-01-01 US disclosed
EP-1851197-A2 PHENYLAZETIDINONE DERIVATIVES Microbia, Inc. (US) 2007-11-07 EP disclosed
WO-2006086562-A2 PHENYLAZETIDINONE DERIVATIVES MICROBIA, INC. (US) 2006-08-17 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-20090005321-A1 Phenylazetidinone Derivatives TYR, AAAS, FANCD2 ERCC1 3050/4885ERCC4 2113/4885FNTA 586/4885

“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.