SCHEMBL721392

SCHEMBL721392

CC(C)C(NP(=O)(Cl)Oc1cccc2ccccc12)C(=O)OC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CASP3 P42574 2/20 0.38
ALDH1A1 P00352 5/20 0.37
MAPT P10636 2/20 0.37
ADAMTS4 O75173 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
CASP8 Q14790 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP19A1 P11511 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EPHX1 P07099 1/20 0.36
CYP2D6 P10635 4/20 0.35
CYP1A2 P05177 3/20 0.35
ADRB2 P07550 3/20 0.35

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
SCHEMBL721393 1.00 MEN1 (0.42) MEN1KMT2ACASP3ALDH1A1MAPT
SCHEMBL722141 0.99 MEN1 (0.41) MEN1KMT2ACASP3ALDH1A1MAPT
SCHEMBL722142 0.99 MEN1 (0.41) MEN1KMT2ACASP3ALDH1A1MAPT
SCHEMBL721561 0.97 MEN1 (0.39) MEN1KMT2ACASP3ALDH1A1CASP1
SCHEMBL721562 0.97 MEN1 (0.39) MEN1KMT2ACASP3ALDH1A1CASP1
SCHEMBL722779 0.90 KAT2B (0.39) MEN1KMT2ACASP3ALDH1A1CASP1
SCHEMBL722780 0.90 KAT2B (0.39) MEN1KMT2ACASP3ALDH1A1CASP1
SCHEMBL722521 0.90 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTADAMTS4
SCHEMBL722522 0.90 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTADAMTS4
SCHEMBL719856 0.89 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTADAMTS4

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-8759318-B2 Phosphoramidate derivatives of guanosine nucleoside compounds for treatment of viral infections INHIBITEX, INC. (US) 2014-06-24 US disclosed
US-20120052046-A1 Phosphoramidate Derivatives of Guanosine Nucleoside Compunds for Treatment of Viral Infections UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2012-03-01 US disclosed
EP-2385951-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS University College Cardiff Consultants, Ltd. (GB) 2011-11-16 EP disclosed
US-20110254856-A1 MOBILE TERMINAL AND METHOD OF CONTROLLING OPERATION OF THE MOBILE TERMINAL LG ELECTRONICS INC. (KR) 2011-10-20 US disclosed
WO-2010081082-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS UNIVERSITY COLLEGE OF CARDIFF CONSULTANTS LIMITED (GB) 2010-07-15 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-20120052046-A1 Phosphoramidate Derivatives of Guanosine Nucleoside Compunds for Treatment of Viral Infections PNP, SAMHD1, MTAP MEN1 1740/4885KMT2A 3637/4885CASP3 2736/4885

“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.