SCHEMBL5379959

SCHEMBL5379959

O=P(O)(CC1CCCCC1)C(O)CCCl

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.41
ALDH1A1 P00352 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
CA9 Q16790 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
FDPS P14324 1/20 0.31
ANPEP P15144 2/20 0.30
ERAP2 Q6P179 2/20 0.30

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
SCHEMBL3420297 0.83 METAP1 (0.45) METAP1CA12CA1CA2MMP1
Hydrochloric Acid SCHEMBL5372878 0.81 METAP1 (0.44) METAP1CA12CA1CA2MMP1
SCHEMBL5087329 0.79 METAP1 (0.40) METAP1CA12CA1CA2MMP1
SCHEMBL5367334 0.74 METAP1 (0.35) METAP1ALDH1A1
SCHEMBL5379957 0.69 METAP1 (0.41) METAP1CA12CA1CA2MMP1
SCHEMBL4047356 0.69 CYP1A2 (0.48) METAP1ALDH1A1CA12CA1CA2
SCHEMBL4047359 0.69 CYP1A2 (0.48) METAP1ALDH1A1CA12CA1CA2
SCHEMBL5379956 0.69 CYP1A2 (0.48) METAP1ALDH1A1CA12CA1CA2
SCHEMBL2331815 0.68 METAP1 (0.50) METAP1ALDH1A1CA12CA1CA2
SCHEMBL10901117 0.68 MMP2 (0.41) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673377-B1 PROCESS FOR THE PREPARATION OF 3-AMINO-2-HYDROXYPROPYLPHOSPHINIC ACID DERIVATIVES AVENTIS PHARMA INC (US) 2013-12-25 EP disclosed
US-7186705-B2 Process for the preparation of 3-amino-2-hydroxypropylphosphinic acid derivatives AVENTIS PHARMACEUTICALS INC. (US) 2007-03-06 US disclosed
US-20050070507-A1 Process for the preparation of 3-amino-2-hydroxypropylphosphinic acid derivatives AVENTIS PHARMACEUTICALS INC. (US) 2005-03-31 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-20050070507-A1 Process for the preparation of 3-amino-2-hydroxypropylphosphinic acid derivatives HTR5A, HPD, HNMT METAP1 156/4885ALDH1A1 1904/4885CA12 2560/4885

“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.