SCHEMBL4017480

SCHEMBL4017480

C1=NCc2cc3ccccc3n21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.41
HTR2A P28223 5/20 0.39
HTR2C P28335 5/20 0.39
KMT2A Q03164 1/20 0.32
ADRA2A P08913 1/20 0.31
TERT O14746 1/20 0.31
DAO P14920 2/20 0.31
MCL1 Q07820 1/20 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
SCHEMBL3203383 0.79 NOTUM (0.37) NOTUMHTR2AHTR2C
SCHEMBL11033039 0.69 HTR2A (0.36) NOTUMHTR2AHTR2CADRA2A
SCHEMBL1873666 0.67 NOTUM (0.42) NOTUMHTR2AHTR2CKMT2ADAO
SCHEMBL10960778 0.65 NOTUM (0.37) NOTUMHTR2AHTR2C
SCHEMBL15466517 0.64 NOTUM (0.43) NOTUMHTR2AHTR2CKMT2ADAO
Hydroxyamine SCHEMBL9656514 0.63 NOTUM (0.39) NOTUMHTR2AHTR2CKMT2ADAO
SCHEMBL11622046 0.63 NOTUM (0.39) NOTUMHTR2AHTR2CKMT2A
SCHEMBL3050639 0.63 HTR2A (0.44) NOTUMHTR2AHTR2CKMT2A
SCHEMBL10917532 0.63 HTR2A (0.39) NOTUMHTR2AHTR2CKMT2A
SCHEMBL11558904 0.61 HTR2A (0.46) NOTUMHTR2AHTR2CKMT2A

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 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030144263-A1 Oxazolidinone derivatives, process for their preparation and pharmaceutical compositions containing them SYNGENTA LIMITED (GB) 2003-07-31 US claimed
US-7498350-B2 Oxazolidinones as antibacterial agents ASTRAZENECA AB (SE) 2009-03-03 US disclosed
US-7473699-B2 3-cyclyl-5-(nitrogen-containing 5-membered ring)methyl-oxazolidinone derivatives and their use as antibacterial agents ASTRAZENECA AB (SE) 2009-01-06 US disclosed
US-20070281916-A1 Substituted isoxazolines and their use as antibacterial agents ASTRAZENECA AB (SE) 2007-12-06 US disclosed
EP-1286998-B2 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2007-10-31 EP disclosed
US-7199143-B2 Chemical compounds ASTRAZENECA AB (SE) 2007-04-03 US disclosed
US-7141583-B2 Oxazolidinone derivatives with antibiotic activity ASTRAZENECA AB (SE) 2006-11-28 US disclosed
US-7081538-B1 Substituted isoxazolines and their use as antibacterial agents ASTRAZENECA AB (SE) 2006-07-25 US disclosed
EP-1385844-B1 OXAZOLIDINONES CONTAINING A SULFONIMID GROUP AS ANTIBIOTICS ASTRAZENECA AB (SE) 2006-07-05 EP disclosed
US-20060116389-A1 Antibacterial oxazolidinones ASTRA ZENECA AB (SE) 2006-06-01 US disclosed
WO-2002080841-A2 ANTIBACTERIAL OXAZOLIDINONES WITH A CYCLIC SULPHILIMINE OR SULPHOXIMINE ASTRAZENECA AB (SE) 2002-10-17 WO disclosed
WO-2002081468-A1 OXAZOLIDINONES AND THEIR USE AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2002-10-17 WO disclosed
EP-1242416-A1 SUBSTITUTED ISOXAZOLINES AND THEIR USE AS ANTIBACTERIAL AGENTS AstraZeneca AB (SE) 2002-09-25 EP disclosed
US-6362191-B1 ANTIBIOTICS ZENECA LTD. (GB) 2002-03-26 US disclosed
WO-2001081350-A1 OXAZOLIDINONE DERIVATIVES WITH ANTIBIOTIC ACTIVITY ASTRAZENECA AB (SE) 2001-11-01 WO disclosed
EP-1121358-A1 HETEROCYCLYLAMINOMETHYLOXAZOLIDINONES AS ANTIBACTERIALS AstraZeneca AB (SE) 2001-08-08 EP disclosed
WO-2001040222-A1 SUBSTITUTED ISOXAZOLINES AND THEIR USE AS ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2001-06-07 WO disclosed
EP-1082323-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AstraZeneca UK Limited (GB) 2001-03-14 EP disclosed
WO-2000021960-A1 HETEROCYCLYL AMINO METHYLOXA ZOLIDINONES AS ANTIBACTERIALS ASTRAZENECA AB (SE) 2000-04-20 WO disclosed
WO-1999064417-A2 OXAZOLIDINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ASTRAZENECA AB (SE) 1999-12-16 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-20030144263-A1 Oxazolidinone derivatives, process for their preparation and pharmaceutical compositions containing them CYP3A5, CYP2D6, OXA1L NOTUM 1494/4885HTR2A 2024/4885HTR2C 1085/4885
US-20070281916-A1 Substituted isoxazolines and their use as antibacterial agents CYP2S1, CYP3A7, CYP3A5 NOTUM 1691/4885HTR2A 1690/4885HTR2C 279/4885
US-20060116389-A1 Antibacterial oxazolidinones MRPL21, WIZ, NRDC NOTUM 2520/4885HTR2A 3082/4885HTR2C 2878/4885

“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.