SCHEMBL2460474

SCHEMBL2460474

O=C(O)C(O)=CC(=O)C1(Cc2ccc(Cl)cc2)CCN(CC2CCCCC2)CC1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.53
OPRL1 P41146 3/20 0.53
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.42
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
KDM2B Q8NHM5 2/20 0.40
SSTR1 P30872 1/20 0.40
SSTR4 P31391 1/20 0.40
OPRK1 P41145 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
OPRD1 P41143 1/20 0.39
CCR5 P51681 1/20 0.38

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
SCHEMBL2460473 1.00 OPRM1 (0.53) OPRM1OPRL1LMNAPOLBTP53
Hydrochloric Acid SCHEMBL8875080 0.83 OPRM1 (0.53) OPRM1OPRL1LMNAPOLBTP53
SCHEMBL29658280 0.82 DRD2 (0.56) LMNAMAPTKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL29461356 0.81 DRD2 (0.55) LMNAPOLBMAPTKDM4EMEN1
Hydrochloric Acid SCHEMBL29461349 0.81 DRD2 (0.55) LMNAPOLBMAPTKDM4EMEN1
SCHEMBL19862763 0.78 NPC1 (0.38) OPRM1OPRL1LMNAPOLBSSTR1
SCHEMBL2462081 0.74 KDM4E (0.51) LMNAPOLBKDM4EMEN1KMT2A
SCHEMBL2463018 0.74 KDM4E (0.51) LMNAPOLBKDM4EMEN1KMT2A
SCHEMBL6841566 0.71 OPRM1 (0.48) OPRM1OPRL1LMNAPOLBTP53
SCHEMBL24249397 0.70 HSD11B1 (0.46) POLBMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180044649-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY EMBL (DE) 2018-02-15 US claimed
US-20160053241-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2016-02-25 US claimed
US-20130023565-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2013-01-24 US claimed
EP-2547696-A2 FRAGMENTS OF THE PA SUBUNIT OF RNA DEPENDENT RNA POLYMERASE FROM PANDEMIC INFLUENZA VIRUS A 2009 H1N1, AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2013-01-23 EP claimed
WO-2011113579-A2 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2011-09-22 WO claimed
EP-2547696-B1 FRAGMENTS OF THE PA SUBUNIT OF RNA DEPENDENT RNA POLYMERASE FROM PANDEMIC INFLUENZA VIRUS A 2009 H1N1, AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY EMBL (DE) 2018-05-23 EP disclosed
US-20180044649-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY EMBL (DE) 2018-02-15 US disclosed
US-9783794-B2 Influenza A 2009 pandemic H1N1 polypeptide fragments comprising endonuclease activity and their use EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2017-10-10 US disclosed
US-20160053241-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2016-02-25 US disclosed
US-9181307-B2 Influenza A 2009 pandemic H1N1 polypeptide fragments comprising endonuclease activity and their use EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2015-11-10 US disclosed
US-20130023565-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2013-01-24 US disclosed
EP-2547696-A2 FRAGMENTS OF THE PA SUBUNIT OF RNA DEPENDENT RNA POLYMERASE FROM PANDEMIC INFLUENZA VIRUS A 2009 H1N1, AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2013-01-23 EP disclosed
WO-2011113579-A2 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2011-09-22 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 (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-20130023565-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE RNASE1, RNASEH1, MME OPRM1 1121/4885OPRL1 2603/4885LMNA 639/4885
US-20160053241-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE RNASE1, ACE, RNASEH1 OPRM1 1973/4885OPRL1 2526/4885LMNA 832/4885
US-20180044649-A1 INFLUENZA A 2009 PANDEMIC H1N1 POLYPEPTIDE FRAGMENTS COMPRISING ENDONUCLEASE ACTIVITY AND THEIR USE RNASE1, ACE, RNASEH1 OPRM1 1973/4885OPRL1 2526/4885LMNA 832/4885

“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.