SCHEMBL9027554

SCHEMBL9027554

CC(C)Cc1cc2ccccc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.58
CASR P41180 2/20 0.50
HRH4 Q9H3N8 1/20 0.49
DPP4 P27487 1/20 0.48
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
AHR P35869 1/20 0.46

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
SCHEMBL30305027 0.85 LOXL2 (0.55) LOXL2CASRHRH4DPP4MTNR1A
SCHEMBL27324837 0.85 LOXL2 (0.59) LOXL2CASRHRH4DPP4
SCHEMBL5365001 0.85 LOXL2 (0.55) LOXL2CASRHRH4DPP4MTNR1A
SCHEMBL2074734 0.85 LOXL2 (0.59) LOXL2CASRHRH4DPP4
SCHEMBL5249054 0.85 LOXL2 (0.55) LOXL2CASRHRH4DPP4MTNR1A
SCHEMBL14680760 0.83 DPP4 (0.54) LOXL2CASRHRH4DPP4MTNR1A
SCHEMBL25146561 0.82 HTR2A (0.45) LOXL2CASRDPP4
SCHEMBL13921282 0.81 LOXL2 (0.55) LOXL2CASRHRH4DPP4MTNR1A
SCHEMBL6254564 0.81 LOXL2 (0.55) LOXL2CASRHRH4MTNR1AMTNR1B
SCHEMBL25973384 0.81 LOXL2 (0.50) LOXL2CASRHRH4DPP4MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239981-A Phosphonite ligand, catalyst and application thereof in hydroformylation reaction 万华化学集团股份有限公司 2024-06-25 CN claimed
US-12043674-B2 Synthetic cyclic peptides and methods of preparation and use thereof AUBURN UNIVERSITY (US) 2024-07-23 US disclosed
US-12043674-B2 Synthetic cyclic peptides and methods of preparation and use thereof AUBURN UNIVERSITY (US) 2024-07-23 US disclosed
CN-118239981-A Phosphonite ligand, catalyst and application thereof in hydroformylation reaction 万华化学集团股份有限公司 2024-06-25 CN disclosed
WO-2023245161-A2 CATIONIC NONRIBOSOMAL LIPOPEPTIDES AND METHODS OF USE THEREOF THE ROCKEFELLER UNIVERSITY (US) 2023-12-21 WO disclosed
US-11807636-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-11-07 US disclosed
US-11759444-B2 Methods for cancer and immunotherapy using prodrugs of glutamine analogs THE JOHNS HOPKINS UNIVERSITY (US) 2023-09-19 US disclosed
US-11759444-B2 Methods for cancer and immunotherapy using prodrugs of glutamine analogs THE JOHNS HOPKINS UNIVERSITY (US) 2023-09-19 US disclosed
WO-2023116779-A1 DIALKYNE COMPOUND AND USE THEREOF 上海艾力斯医药科技股份有限公司 2023-06-29 WO disclosed
WO-2023081832-A1 METHODS FOR PREVENTING AND TREATING ACUTE KIDNEY INJURY THE JOHNS HOPKINS UNIVERSITY (US) 2023-05-11 WO disclosed
US-20110117158-A1 INHIBITION AND DISPERSION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-TRIAZOLE DERIVATIVES MELANDER CHRISTIAN 2011-05-19 US disclosed
US-7642265-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2010-01-05 US disclosed
US-7579479-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-25 US disclosed
US-20090170805-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-07-02 US disclosed
US-20080227684-A1 Small Molecule Inhibitors of PDZ Interactions NONO INC. (CA) 2008-09-18 US disclosed
US-7241780-B2 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method BRISTOLS-MYERS SQUIBB COMPANY (US) 2007-07-10 US disclosed
US-20070015797-A1 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method CHENG PETER T 2007-01-18 US disclosed
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP 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 (7 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-11759444-B2 Methods for cancer and immunotherapy using prodrugs of glutamine analogs ADORA2A, ADORA1, ADORA2B LOXL2 2270/4885CASR 1326/4885HRH4 1280/4885
US-12043674-B2 Synthetic cyclic peptides and methods of preparation and use thereof VIP, PTMS, IAPP LOXL2 4704/4885CASR 3726/4885HRH4 1823/4885
US-20110117158-A1 INHIBITION AND DISPERSION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-TRIAZOLE DERIVATIVES TFPI, O60361, TFPI2 LOXL2 2376/4885CASR 2942/4885HRH4 2704/4885
US-20080227684-A1 Small Molecule Inhibitors of PDZ Interactions PDLIM5, DAB2IP, PSD LOXL2 4306/4885CASR 2577/4885HRH4 3510/4885
US-11807636-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 LOXL2 881/4885CASR 1297/4885HRH4 3886/4885
US-20070015797-A1 Substituted acid derivatives useful as antidiabetic and antiobesity agents and method GPR119, LIPC, ACACA LOXL2 2763/4885CASR 3814/4885HRH4 840/4885
US-20090170805-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF ACAT1, ACAT2, APEH LOXL2 3547/4885CASR 1197/4885HRH4 1731/4885

“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.