SCHEMBL669484

SCHEMBL669484

Cc1ccccc1C(C)OC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
ESR1 P03372 1/20 0.44
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
ACP3 P15309 1/20 0.39
NR3C2 P08235 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
KCNH2 Q12809 1/20 0.36
POLB P06746 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL16672485 0.83 ESR1 (0.45) ALDH1A1ESR1ADRA2AADRA2BADRA2C
SCHEMBL28393933 0.83 ESR1 (0.45) ALDH1A1ESR1ADRA2AADRA2BADRA2C
SCHEMBL10347902 0.83 ESR1 (0.45) ALDH1A1ESR1ADRA2AADRA2BADRA2C
SCHEMBL17446319 0.82 ALDH1A1 (0.42) ALDH1A1ESR1ACP3NR3C2IRAK4
SCHEMBL17446318 0.82 ALDH1A1 (0.42) ALDH1A1ESR1ACP3NR3C2IRAK4
SCHEMBL9657238 0.81 ALDH1A1 (0.39) ALDH1A1IRAK4KDM4E
SCHEMBL9422687 0.81 GABRA1 (0.50) ALDH1A1IRAK4POLBKDM4EMAPT
SCHEMBL27945388 0.81 CYP1A2 (0.36) ALDH1A1ADRA2AADRA2CIRAK4KDM4E
SCHEMBL16672549 0.81 ESR1 (0.44) ALDH1A1ESR1ADRA2AADRA2BADRA2C
SCHEMBL515081 0.80 CHRNB2 (0.47) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1241152-B1 Temperature-insensitive propellant powder NITROCHEMIE WIMMIS AG (CH) 2010-10-06 EP claimed
WO-2026089784-A2 COMPOUNDS AND COMPOSITIONS FOR CONJUGATION TO BIOLIGANDS FOR IMAGING AND RADIOPHARMACEUTICAL APPLICATIONS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2026-04-30 WO disclosed
WO-2025104706-A2 SMALL MOLECULE MODULATORS OF MAS AND MRGD RECEPTORS XITRA THERAPEUTICS GMBH (DE) 2025-05-22 WO disclosed
EP-4554671-A1 CYCLIC PEPTIDE INHIBITORS OF IL-23 JANSSEN Pharmaceutica NV (BE) 2025-05-21 EP disclosed
WO-2025003755-A1 HELPER LIPIDS FOR NUCLEIC ACID DELIVERY SANOFI (FR) 2025-01-02 WO disclosed
EP-4419536-A1 OLIGONUCLEOTIDES WITH 2'-DEOXY-2'-F-2'-C-METHYL NUCLEOTIDES Alnylam Pharmaceuticals, Inc. (US) 2024-08-28 EP disclosed
WO-2024163962-A1 3-((1,1-DIOXIDO-2,3,4,5-TETRAHYDROBENZO[F][1,2,5]THIADIAZEPIN-8-YL)OXY)-2-FLUOROACRYLIC ACID DERIVATIVES AS SODIUM TAUROCHOLATE CO-TRANSPORTING POLYPEPTIDE (NTCP) INHIBITORS FOR THE TREATMENT OF CHOLESTASIS Hemoshear Therapeutics, Inc. (US) 2024-08-08 WO disclosed
WO-2024148274-A1 COMPLEMENT INHIBITION APELLIS PHARMACEUTICALS, INC. (US) 2024-07-11 WO disclosed
EP-3044190-B1 BURN RATE MODIFIER THALES AUSTRALIA LTD (AU) 2024-07-03 EP disclosed
WO-2024133853-A1 BIS-ESTER AND AMIDE CATIONIC LIPIDS SANOFI (FR) 2024-06-27 WO disclosed
EP-0804410-B1 METHOD OF PREPARING RETROVIRAL PROTEASE INHIBITOR INTERMEDIATES SEARLE & CO (US) 2001-08-29 EP disclosed
EP-0804410-A1 METHOD OF PREPARING RETROVIRAL PROTEASE INHIBITOR INTERMEDIATES G.D. SEARLE & CO. (US) 1997-11-05 EP disclosed
EP-0730570-A1 METHOD FOR MAKING INTERMEDIATES USEFUL IN SYNTHESIS OF RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1996-09-11 EP disclosed
WO-1996022275-A1 METHOD OF PREPARING RETROVIRAL PROTEASE INHIBITOR INTERMEDIATES G.D. SEARLE & CO. (US) 1996-07-25 WO disclosed
EP-0651761-A1 METHOD FOR MODIFICATION OF RECOMBINANT POLYPEPTIDES BIONEBRASKA, INC. (US) 1995-05-10 EP disclosed
WO-1994001451-A2 METHOD FOR MODIFICATION OF RECOMBINANT POLYPEPTIDES BIONEBRASKA, INC. (US) 1994-01-20 WO disclosed
EP-0222889-A4 CYTIDINE ANALOGS. INTEGRATED GENETICS INC (US) 1988-09-28 EP disclosed
US-4684728-A Solubilizing biologically active compounds with reactive hydrogen atoms BAYER AKTIENGESELLSCHAFT (DE) 1987-08-04 US disclosed
EP-0222889-A1 CYTIDINE ANALOGS. INTEGRATED GENETICS INC (US) 1987-05-27 EP disclosed
WO-1986006726-A1 CYTIDINE ANALOGS INTEGRATED GENETICS, INC. (US) 1986-11-20 WO disclosed