SCHEMBL2954900

SCHEMBL2954900

NC(F)CCP(=O)(O)CC1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.47
ANPEP P15144 2/20 0.36
ERAP2 Q6P179 2/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
CA9 Q16790 1/20 0.34
ALOX5 P09917 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
GRIN2D O15399 5/20 0.32
GRIN3B O60391 5/20 0.32
GRIN1 Q05586 5/20 0.32
GRIN2A Q12879 5/20 0.32
GRIN2B Q13224 5/20 0.32

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
SCHEMBL2951190 0.85 METAP1 (0.49) METAP1ANPEPERAP2CA12CA1
Hydrochloric Acid SCHEMBL5372871 0.83 METAP1 (0.47) METAP1ANPEPERAP2CA12CA1
SCHEMBL5379957 0.78 METAP1 (0.41) METAP1ANPEPERAP2CA12CA1
SCHEMBL5093197 0.74 CA12 (0.37) METAP1CA12CA1CA2MMP1
SCHEMBL398615 0.74 GABBR2 (0.47) METAP1CYP1A2CYP3A4
SCHEMBL5509358 0.73 CA12 (0.39) METAP1CA12CA1CA2MMP1
SCHEMBL5087334 0.72 CA12 (0.38) METAP1CA12CA1CA2MMP1
SCHEMBL7608860 0.71 FOLH1 (0.55)
SCHEMBL8286618 0.70 CA12 (0.37) METAP1CA12CA1CA2MMP1
SCHEMBL10901126 0.70 LMNA (0.43) METAP1CA12CA1CA2MMP1

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
US-7749985-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. (US) 2010-07-06 US disclosed
US-20090286759-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2009-11-19 US disclosed
US-7585996-B2 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. (US) 2009-09-08 US disclosed
US-20080146526-A1 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use XENOPORT, INC. 2008-06-19 US disclosed
WO-2008033572-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2008-03-20 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 (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-20090286759-A1 ACYLOXYALKYL CARBAMATE PRODRUGS, METHODS OF SYNTHESIS AND USE APEH, NAPEPLD, AASDHPPT METAP1 1054/4885ANPEP 88/4885ERAP2 623/4885
US-20080146526-A1 Acyloxyalkyl carbamate prodrugs, methods of synthesis and use APEH, NAPEPLD, AASDHPPT METAP1 1054/4885ANPEP 88/4885ERAP2 623/4885

“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.