SCHEMBL2186641

SCHEMBL2186641

C1=C\c2ccccc2-c2ccccc2\N=C/1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
BCHE P06276 1/20 0.33
POLB P06746 1/20 0.33
PTPRC P08575 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.33
IDO1 P14902 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
PTPN1 P18031 1/20 0.33
ACHE P22303 1/20 0.33
CES1 P23141 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PTPN22 Q9Y2R2 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
SCHEMBL2186647 1.00 KDM4E (0.33) KDM4EMEN1ALDH1A1LMNABCHE
SCHEMBL10512958 0.83 PTPRC (0.33) PTPRC
SCHEMBL30816755 0.77 MEN1 (0.33) KDM4EMEN1ALDH1A1LMNABCHE
SCHEMBL379612 0.74 TRPA1 (0.33) TRPA1
SCHEMBL379614 0.74 TRPA1 (0.33) TRPA1
SCHEMBL568780 0.74 MEN1 (0.46) KDM4EMEN1ALDH1A1LMNABCHE
SCHEMBL504078 0.74 MEN1 (0.46) KDM4EMEN1ALDH1A1LMNABCHE
Fluoride SCHEMBL28557472 0.72 TRPA1 (0.32) TRPA1
SCHEMBL9985286 0.71 MEN1 (0.44) KDM4EMEN1ALDH1A1LMNABCHE
SCHEMBL9985289 0.71 MEN1 (0.44) KDM4EMEN1ALDH1A1LMNABCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024086781-A2 METHODS AND SYSTEMS FOR CHARACTERIZING PHOSPHOSERINE-CONTAINING POLYPEPTIDES Quantum-Si Incorporated (US) 2024-04-25 WO claimed
WO-2024073442-A1 METHODS FOR ISOLATING, DETECTING, AND QUANTIFYING INTERCELLULAR PROTEINS FRED HUTCHINSON CANCER CENTER (US) 2024-04-04 WO claimed
US-11938196-B2 Modified viral particles for gene therapy BOREA THERAPEUTICS S.R.L. (IT) 2024-03-26 US claimed
US-20240016933-A1 Methods of Anchoring or Reconstituting Active Molecules on Metabolically Labeled Cells MASSACHUSETTS GEN HOSPITAL (US) 2024-01-18 US claimed
US-20240002908-A1 METHODS OF DETERMINING SURFACE GLYCAN DENSITY MASSACHUSETTS GEN HOSPITAL (US) 2024-01-04 US claimed
US-20230406839-A1 Bifunctional Compounds And Methods Of Using The Same THE GENERAL HOSPITAL CORPORATION 2023-12-21 US claimed
WO-2023212656-A1 BIOMATERIALS FOR IMPROVING BRAIN HEALING AFTER STROKE AND METHODS OF USING SAME DUKE UNIVERSITY (US) 2023-11-02 WO claimed
US-20230338578-A1 MODIFIED VIRAL PARTICLES FOR GENE THERAPY EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2023-10-26 US claimed
WO-2023178422-A1 LIPID BASED NANOPARTICLES FOR TARGETED GENE DELIVERY TO THE BRAIN NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2023-09-28 WO claimed
WO-2023178421-A1 ANTIBODIES WITH ENGINEERED O-GLYCOSYLATION SEQUONS FOR SITE-SPECIFIC CONJUGATION NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2023-09-28 WO claimed
US-20120108499-A1 PEPTOID COMPOUNDS UNIVERSITY OF WOLLONGONG (AU) 2012-05-03 US claimed
EP-2343285-A2 Peptoid compounds UNIVERSITY OF WOLLONGONG (AU) 2011-07-13 EP claimed
US-20100167995-A1 PEPTOID COMPOUNDS UNIVERSITY OF WOLLONGONG (AU) 2010-07-01 US claimed
JP-4446736-B2 2010-04-07 JP claimed
EP-1412336-A4 PEPTOID COMPOUNDS UNIV WOLLONGONG (AU) 2007-08-29 EP claimed
US-20070111927-A1 Peptoid compounds UNIVERSITY OF WOLLONGONG (AU) 2007-05-17 US claimed
US-20050043509-A1 Peptoid compounds UNIVERSITY OF WOLLONGONG 2005-02-24 US claimed
JP-2005504734-A 2005-02-17 JP claimed
EP-1412336-A1 PEPTOID COMPOUNDS UNIVERSITY OF WOLLONGONG (AU) 2004-04-28 EP claimed
WO-2003002545-A1 PEPTOID COMPOUNDS UNIVERSITY OF WOLLONGONG (AU) 2003-01-09 WO 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 (8 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-20120108499-A1 PEPTOID COMPOUNDS VIP, FPR1, VIPR1 KDM4E 4594/4885MEN1 3065/4885ALDH1A1 4540/4885
US-20100167995-A1 PEPTOID COMPOUNDS VIP, FPR1, VIPR1 KDM4E 4594/4885MEN1 3065/4885ALDH1A1 4540/4885
US-20240016933-A1 Methods of Anchoring or Reconstituting Active Molecules on Metabolically Labeled Cells CD4, CD14, CD69 KDM4E 4309/4885MEN1 3721/4885ALDH1A1 2659/4885
US-20230338578-A1 MODIFIED VIRAL PARTICLES FOR GENE THERAPY HAVCR2, TMEM205, COPA KDM4E 4208/4885MEN1 4445/4885ALDH1A1 2068/4885
US-20070111927-A1 Peptoid compounds VIP, FPR1, VIPR1 KDM4E 4594/4885MEN1 3065/4885ALDH1A1 4540/4885
US-11938196-B2 Modified viral particles for gene therapy HAVCR2, TMEM205, COPA KDM4E 4208/4885MEN1 4445/4885ALDH1A1 2068/4885
US-20230406839-A1 Bifunctional Compounds And Methods Of Using The Same PAICS, PAPSS1, GNE KDM4E 3714/4885MEN1 1168/4885ALDH1A1 1596/4885
US-20050043509-A1 Peptoid compounds VIP, FPR1, VIPR1 KDM4E 4594/4885MEN1 3065/4885ALDH1A1 4540/4885

“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.