SCHEMBL3739664

SCHEMBL3739664

O=P(O)(O)C(CCN1CCCC1)P(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.47
ERAP2 Q6P179 1/20 0.47
MAPT P10636 3/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
FDPS P14324 8/20 0.43
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
TSHR P16473 1/20 0.34

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
SCHEMBL9081590 0.98 ANPEP (0.50) ANPEPERAP2MAPTCA12CA1
SCHEMBL8597910 0.77 ANPEP (0.61) ANPEPERAP2MAPTCA12CA1
SCHEMBL8675612 0.76 ANPEP (0.64) ANPEPERAP2MAPTCA12CA1
SCHEMBL8991677 0.76 ANPEP (0.64) ANPEPERAP2MAPTCA12CA1
SCHEMBL9451579 0.74 ANPEP (0.47) ANPEPERAP2MAPTCA12CA1
SCHEMBL8843433 0.72 CA12 (0.40) ANPEPERAP2MAPTCA12CA1
SCHEMBL9160362 0.71 ANPEP (0.38) ANPEPERAP2MAPTCA12CA1
SCHEMBL8842734 0.71 CA12 (0.41) ANPEPERAP2MAPTCA12CA1
Hydrochloric Acid SCHEMBL25311139 0.71 MAPT (0.52) ANPEPERAP2MAPTCA12CA1
SCHEMBL9709649 0.71 HRH3 (0.48) ANPEPERAP2MAPTCA12CA1

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
EP-2150258-A2 IMPROVED METHODS OF USING PHOSPHOANTIGENS TOGETHER WITH INTERLEUKIN-2 FOR THE TREATMENT OF CANCER Innate Pharma S.A. (FR) 2010-02-10 EP disclosed
US-20090202572-A1 COMPOSITIONS AND METHODS FOR MODULATING BONE MASS BAYLOR COLLEGE OF MEDICINE 2009-08-13 US disclosed
WO-2008146167-A2 IMPROVED METHODS OF USING PHOSPHOANTIGENS TOGETHER WITH INTERLEUKIN-2 FOR THE TREATMENT OF CANCER INNATE PHARMA S.A. (FR) 2008-12-04 WO disclosed
WO-2006102674-A2 DIPHENYLHETEROCYCLE CHOLESTEROL ABSORPTION INHIBITORS MICROBIA, INC. (US) 2006-09-28 WO disclosed
US-5728650-A Herbicidal aza bisphosphonic acids and compositions containing the same ZENECA LIMITED (GB) 1998-03-17 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-20090202572-A1 COMPOSITIONS AND METHODS FOR MODULATING BONE MASS ADRB2, ADRA2A, ADRB1 ANPEP 1618/4885ERAP2 1300/4885MAPT 3969/4885

“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.