SCHEMBL258690

SCHEMBL258690

O=c1c2ccccc2ncn1O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
HPGD P15428 1/20 0.54
HSD17B10 Q99714 1/20 0.54
USP5 P45974 1/20 0.53
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 5/20 0.51
TSHR P16473 1/20 0.49
NPC1 O15118 2/20 0.49
GAA P10253 2/20 0.49
PKM P14618 1/20 0.49
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL3636921 0.78 RAB9A (0.57) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL6972582 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL122167 0.76 ACVR1 (0.61) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL3190592 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL16181504 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL30743619 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL29723028 0.76 ACVR1 (0.61) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL28248362 0.76 RAB9A (0.56) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL22021641 0.76 KDM4E (0.54) KDM4EHPGDHSD17B10USP5RAB9A
SCHEMBL6773633 0.76 USP5 (0.56) KDM4EHPGDHSD17B10USP5RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210128777-A1 ADDITIVE ABLE TO PROVIDE UNDERWATER ADHESION BAXTER HEALTHCARE SA (CH) 2021-05-06 US claimed
US-8524898-B2 Proton acceptor iminium/carbocation-type coupling agents LUXEMBOURG BIO TECHNOLOGIES LTD. (IL) 2013-09-03 US claimed
US-8303973-B2 Multifunctional compounds for forming crosslinked biomaterials and methods of preparation and use ANGIOTECH PHARMACEUTICALS (US), INC. (US) 2012-11-06 US claimed
US-20100144588-A1 PROTON ACCEPTOR IMINIUM/CARBOCATION-TYPE COUPLING AGENTS LUXEMBOURG BIO TECHNOLOGIES LTD. (IL) 2010-06-10 US claimed
EP-2170822-A2 PROTON ACCEPTOR IMINIUM/CARBOCATION-TYPE COUPLING AGENTS Luxembourg Bio Technologies Ltd. (IL) 2010-04-07 EP claimed
WO-2009138985-A2 COUPLING AGENTS FOR THE SYNTHESIS OF POLYPEPTIDES AND POLYNUCLEOTIDES LUXEMBOURG BIO TECHNOLOGIES LTD. (IL) 2009-11-19 WO claimed
US-20080312315-A1 Multifunctional Compounds for Forming Crosslinked Biomaterials and Methods of Preparation and Use ANGIOTECH PHARMACEUTICALS(US),INC. (US) 2008-12-18 US claimed
WO-2008139481-A2 PROTON ACCEPTOR IMINIUM/CARBOCATION-TYPE COUPLING AGENTS LUXEMBOURG BIO TECHNOLOGIES LTD. (IL) 2008-11-20 WO claimed
EP-1796602-A2 MULTIFUNCTIONAL COMPOUNDS FOR FORMING CROSSLINKED BIOMATERIALS AND METHODS OF PREPARATION AND USE Angiotech Pharmaceuticals (US), Inc. (US) 2007-06-20 EP claimed
WO-2006083260-A2 COMPOSITIONS AND SYSTEMS FOR FORMING CROSSLINKED BIOMATERIALS AND ASSOCIATED METHODS OF PREPARATION AND USE ANGIOTECH BIOMATERIALS CORPORATION (US) 2006-08-10 WO claimed
US-20050281883-A1 Compositions and systems for forming crosslinked biomaterials and associated methods of preparation and use ANGIODEVICE INTERNATIONAL GMBH (CH) 2005-12-22 US claimed
EP-0611774-B1 Production of amides and peptides without racemization in the presence of catalytic amounts of a N-hydroxy-compound HOFFMANN LA ROCHE (CH) 1999-05-26 EP claimed
US-5750649-A REACTING ACID AND AMINE IN PRESENCE OF CARBODIIMIDE DEHYDRATING AGENT AND N-HYDROXY COMPOUND; PEPTIDES HOFFMANN-LA ROCHE INC. (US) 1998-05-12 US claimed
CN-1035873-C Preparation of amides and peptides HOFFMANN LA ROCHE (CH) 1997-09-17 CN claimed
US-5536816-A Process for producing amides using catalytic amounts of an N-hydroxy compound HOFFMANN-LA ROCHE INC. (US) 1996-07-16 US claimed
CN-1111237-A Preparation of amides and peptides HOFFMANN LA ROCHE (CH) 1995-11-08 CN claimed
EP-0611774-A1 Production of amides and peptides without racemization in the presence of catalytic amounts of a N-hydroxy-compound F. HOFFMANN-LA ROCHE AG (CH) 1994-08-24 EP claimed
EP-0073912-B1 OXO-QUINAZOLINE-(THIONO)-PHOSPHORIC(PHOSPHONIC)-ACID ESTERS OR AMIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1985-03-20 EP claimed
EP-0101902-A1 Oxoquinazoline-carbamic-acid ester BAYER AG (DE) 1984-03-07 EP claimed
EP-0073912-A1 Oxo-quinazoline-(thiono)-phosphoric(phosphonic)-acid esters or amides, process for their preparation and their use as pesticides BAYER AG (DE) 1983-03-16 EP 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 (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-20100144588-A1 PROTON ACCEPTOR IMINIUM/CARBOCATION-TYPE COUPLING AGENTS PHAX, GIPR, IAPP KDM4E 4871/4885HPGD 898/4885HSD17B10 3915/4885
US-20050281883-A1 Compositions and systems for forming crosslinked biomaterials and associated methods of preparation and use ILK, FN1, MMP1 KDM4E 3657/4885HPGD 1046/4885HSD17B10 3973/4885
US-20080312315-A1 Multifunctional Compounds for Forming Crosslinked Biomaterials and Methods of Preparation and Use ILK, PLOD3, MMP1 KDM4E 3108/4885HPGD 628/4885HSD17B10 4080/4885

“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.