SCHEMBL296281

SCHEMBL296281

CC(C)=CCCC(C)=CCCC(C)=CCS

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
MAPT P10636 2/20 0.64
MEN1 O00255 2/20 0.64
CYP3A4 P08684 2/20 0.64
ALOX15 P16050 2/20 0.64
ALDH1A1 P00352 1/20 0.64
UGT1A1 P22309 1/20 0.64
SQLE Q14534 7/20 0.61
KDM4E B2RXH2 1/20 0.57
FNTA P49354 2/20 0.53
FNTB P49356 2/20 0.53

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
SCHEMBL12555811 1.00 KMT2A (0.73) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL12412583 1.00 KMT2A (0.73) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL331851 1.00 KMT2A (0.73) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL3791172 1.00 KMT2A (0.73) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL3503739 0.98 KMT2A (0.68) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL1472304 0.98 KMT2A (0.68) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL332318 0.98 KMT2A (0.68) KMT2AMAPTMEN1CYP3A4ALOX15
SCHEMBL8064939 0.86 KMT2A (0.73) KMT2AMAPTMEN1CYP3A4ALOX15
Squalene SCHEMBL28619973 0.86 KMT2A (0.81) KMT2AMAPTMEN1CYP3A4ALOX15
Squalene SCHEMBL28619974 0.86 KMT2A (0.81) KMT2AMAPTMEN1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8217145-B2 Genetically programmed expression of proteins containing the unnatural amino acid phenylselenocysteine THE SCRIPS RESEARCH INSTITUTE (US) 2012-07-10 US claimed
US-20090209000-A1 Genetically Programmed Expression of Proteins THE SCRIPPS RESEARCH INSTITUTE 2009-08-20 US claimed
CN-101405401-A Genetic programming expression of protein containing unnatural amino acid phenylselenocysteine SCRIPPS RESEARCH INST (US) 2009-04-08 CN claimed
EP-1994165-A2 GENETICALLY PROGRAMMED EXPRESSION OF PROTEINS CONTAINING THE UNNATURAL AMINO ACID PHENYLSELENOCYSTEINE The Scripps Research Institute (US) 2008-11-26 EP claimed
US-20070238152-A1 Genetically programmed expression of proteins containing the unnatural amino acid phenylselenocysteine THE SCRIPPS RESEARCH INSTITUTE (US) 2007-10-11 US claimed
WO-2007109035-A2 GENETICALLY PROGRAMMED EXPRESSION OF PROTEINS CONTAINING THE UNNATURAL AMINO ACID PHENYLSELENOCYSTEINE THE SCRIPPS RESEARCH INSTITUTE (US) 2007-09-27 WO claimed
EP-0482342-A2 Hypocholesterolemic unsymmetrical dithiol ketals Bristol-Myers Squibb Company (US) 1992-04-29 EP claimed
WO-2025030241-A1 COATING MATERIALS BASED ON FUNCTIONALIZED ORGANIC MOLECULES AND USES THEREOF IN ELECTROCHEMICAL APPLICATIONS HYDRO-QUéBEC (CA) 2025-02-13 WO disclosed
US-20240017996-A1 FLUORINATION PROCESSES UNIVERSITY COLLEGE LONDON (GB) 2024-01-18 US disclosed
US-20230339829-A1 FLUORINATION PROCESSES UNIVERSITY COLLEGE LONDON (GB) 2023-10-26 US disclosed
WO-2023118867-A1 CAF2-BASED FLUORINATION REAGENTS, METHODS OF PREPARATION AND USES THEREOF OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2023-06-29 WO disclosed
US-20160326212-A1 Chemical Modification of Proteins R.P. SCHERER TECHNOLOGIES, LLC 2016-11-10 US disclosed
US-9346851-B2 Chemical modification of proteins R.P. SCHERER TECHNOLOGIES, LLC (US) 2016-05-24 US disclosed
WO-2008066816-A2 DERIVATIZATION OR LIGATON OF PEPTIDES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-06-05 WO disclosed
US-20070238152-A1 Genetically programmed expression of proteins containing the unnatural amino acid phenylselenocysteine THE SCRIPPS RESEARCH INSTITUTE (US) 2007-10-11 US disclosed
WO-2007109035-A2 GENETICALLY PROGRAMMED EXPRESSION OF PROTEINS CONTAINING THE UNNATURAL AMINO ACID PHENYLSELENOCYSTEINE THE SCRIPPS RESEARCH INSTITUTE (US) 2007-09-27 WO disclosed
EP-0640590-A1 Process for the synthesis of 4-mercaptophenols and naphthalenols Bristol-Myers Company (US) 1995-03-01 EP disclosed
US-5321046-A Hypocholesterolemic unsymmetrical dithiol ketals BRISTOL-MYERS SQUIBB COMPANY (US) 1994-06-14 US disclosed
EP-0482342-A2 Hypocholesterolemic unsymmetrical dithiol ketals Bristol-Myers Squibb Company (US) 1992-04-29 EP disclosed
US-4067910-A HEATING ALLYL XANTHOGENATE GIVAUDAN CORPORATION (US) 1978-01-10 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 (4 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-20070238152-A1 Genetically programmed expression of proteins containing the unnatural amino acid phenylselenocysteine NPEPPS, AARS1, NSUN3 KMT2A 1397/4885MAPT 3007/4885MEN1 4532/4885
US-20230339829-A1 FLUORINATION PROCESSES PPIP5K2, PFAS, ARFGEF1 KMT2A 3626/4885MAPT 3067/4885MEN1 397/4885
US-20160326212-A1 Chemical Modification of Proteins SCLY, PTMS, QPCT KMT2A 2362/4885MAPT 3827/4885MEN1 3233/4885
US-20090209000-A1 Genetically Programmed Expression of Proteins AARS1, COASY, NPEPPS KMT2A 1806/4885MAPT 2947/4885MEN1 4588/4885

“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.