SCHEMBL528149

SCHEMBL528149

CCCCCON1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.41
L3MBTL1 Q9Y468 4/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK1 P28482 2/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 2/20 0.37
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
RECQL P46063 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
CYP1A2 P05177 1/20 0.33

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
SCHEMBL30800827 0.98 LTA4H (0.43) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL8432395 0.98 LTA4H (0.42) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL9275922 0.95 LTA4H (0.44) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL14759523 0.95 LTA4H (0.44) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL7828731 0.93 LTA4H (0.38) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL3127470 0.93 TSHR (0.42) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL4917509 0.91 TSHR (0.39) LTA4HL3MBTL1MEN1KMT2ATDP1
SCHEMBL8972630 0.86 THRB (0.40) LTA4HMEN1KMT2ATDP1MAPT
SCHEMBL4175721 0.86 THRB (0.40) LTA4HMEN1KMT2ATDP1MAPT
SCHEMBL10378875 0.86 THRB (0.40) LTA4HMEN1KMT2ATDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3221307-B1 NOVEL 1,3,5 -TRIAZINE BASED PI3K INHIBITORS AS ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2019-07-24 EP claimed
US-9951040-B2 1,3,5 -triazine based PI3K inhibitors as anticancer agents and a process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2018-04-24 US claimed
US-20170342049-A1 NOVEL 1,3,5 -TRIAZINE BASED PI3K INHIBITORS AS ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2017-11-30 US claimed
EP-3221307-A1 NOVEL 1,3,5 -TRIAZINE BASED PI3K INHIBITORS AS ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2017-09-27 EP claimed
WO-2016079760-A1 NOVEL 1,3,5 -TRIAZINE BASED PI3K INHIBITORS AS ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-05-26 WO claimed
US-9184428-B2 Non-aqueous electrolytes for lithium ion batteries UCHICAGO ARGONNE LLC (US) 2015-11-10 US claimed
US-20150148464-A1 FLAME RETARDANT COMPOSITIONS OF PHOSPHINIC ACID SALTS AND NITROXYL DERIVATIVES BASF SE (DE) 2015-05-28 US claimed
US-9012096-B2 Long life lithium batteries with stabilized electrodes UCHICAGO ARGONNE, LLC (US) 2015-04-21 US claimed
CN-103025812-B Phosphinic acid hydrazide flame retardant compositions BASF SE 2014-08-13 CN claimed
CN-102471533-B Phenylphosphonate flame retardant compositions BASF SE 2014-07-02 CN claimed
WO-2005066290-A1 INK JET INK COMPOSITION EASTMAN KODAK COMPANY (US) 2005-07-21 WO claimed
US-20050134665-A1 Ink jet ink composition EASTMAN KODAK COMPANY 2005-06-23 US claimed
EP-1201720-B1 Printing fluid additives promoting overcoat adhesion HEWLETT PACKARD CO (US) 2004-09-15 EP claimed
US-6610412-B2 Clear protective thermal transfer overcoating and acrylic polymer compatibilizer; computer prints HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2003-08-26 US claimed
US-20030119973-A1 Printing fluid additives promoting overcoat adhesion HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2003-06-26 US claimed
US-6417249-B1 INK JET PRINTING INK FOR COLOR VEHICLES, CORE/SHELL BINDERS, SMUDGE PROOF HEWLETT-PACKARD COMPANY 2002-07-09 US claimed
EP-1201720-A1 Printing fluid additives promoting overcoat adhesion Hewlett-Packard Company (US) 2002-05-02 EP claimed
US-6248805-B1 THERMAL INK JET PRNTING HEWLETT-PACKARD COMPANY 2001-06-19 US claimed
US-6057384-A VEHICLE AND COLORANT ASSOCIATED WITH A PRIMER CORE/SHELL POLYMER; DURABLR SMEAR-FAST FILM HEWLETT-PACKARD COMPANY (US) 2000-05-02 US claimed
US-5990202-A DURABLE, SMEAR-FAST INK FILMS COMPRISING DUAL ENCAPSULATED COLORANT; A PRIMER CORE/SHELL POLYMER COATING A COLORANT (ADHESION) AND AN EXTERIOR CORE/SHELL POLYMER COATING FOR DURABILITY HEWLETT-PACKARD COMPANY (US) 1999-11-23 US claimed

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-20170342049-A1 NOVEL 1,3,5 -TRIAZINE BASED PI3K INHIBITORS AS ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF PIK3CA, PIK3R5, PIK3CD LTA4H 3545/4885L3MBTL1 4391/4885MEN1 1578/4885

“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.