SCHEMBL1764713

SCHEMBL1764713

O=C(NC(c1ccccc1)[PH](=O)O)C(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.42
CES1 P23141 5/20 0.42
LMNA P02545 6/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP2D6 P10635 1/20 0.38
SRC P12931 1/20 0.38
CTRB1 P17538 1/20 0.38
GPR139 Q6DWJ6 1/20 0.38
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL1764710 1.00 CES2 (0.42) CES2CES1LMNAHPGDL3MBTL1
SCHEMBL12018317 0.71 CES2 (0.52) CES2CES1LMNAHPGDL3MBTL1
SCHEMBL8827718 0.70 CTSK (0.51) MAPT
SCHEMBL1764167 0.69 MTOR (0.39) LMNAHPGDCYP2D6SRCMAPK1
SCHEMBL7719888 0.69 CTRB1 (0.52) LMNACYP2D6CTRB1ALDH1A1SMN1; SMN2
Benzil SCHEMBL11423943 0.69 CES2 (0.78) CES2CES1LMNAHPGDL3MBTL1
SCHEMBL9388831 0.67 SMN1; SMN2 (0.47) CES2CES1LMNAHPGDL3MBTL1
SCHEMBL14397456 0.67 LMNA (0.54) CES2CES1LMNAHPGDALDH1A1
SCHEMBL15275314 0.66 ACP3 (0.51) LMNACYP2D6MAPK1ALDH1A1SMN1; SMN2
SCHEMBL9123895 0.65 CES2 (0.62) CES2CES1HPGDL3MBTL1TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10131681-B2 Aminophosphinic derivatives that can be used in the treatment of pain PHARMALEADS (FR) 2018-11-20 US disclosed
US-20140161839-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN PHARMALEADS (FR) 2014-06-12 US disclosed
US-8703747-B2 Aminophosphinic derivatives that can be used in the treatment of pain PHARMALEADS (FR) 2014-04-22 US disclosed
US-20110124601-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN PHARMALEADS 2011-05-26 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 (3 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-20110124601-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN OPRM1, HRH3, HRH4 CES2 1104/4885CES1 1841/4885LMNA 4645/4885
US-10131681-B2 Aminophosphinic derivatives that can be used in the treatment of pain OPRM1, HRH3, HRH4 CES2 1040/4885CES1 1812/4885LMNA 4614/4885
US-20140161839-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN OPRM1, HRH3, HRH4 CES2 1040/4885CES1 1812/4885LMNA 4614/4885

“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.