SCHEMBL6605025

SCHEMBL6605025

O=C(O)C(C(=O)O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.67
ALDH1A1 P00352 3/20 0.65
TSHR P16473 2/20 0.63
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 3/20 0.46
GPR35 Q9HC97 1/20 0.45
HSD17B10 Q99714 1/20 0.44
SRC P12931 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CTSD P07339 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
MAOB P27338 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL2598761 1.00 CYP1A2 (0.67) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL16335088 0.85 CYP1A2 (0.67) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL16335086 0.85 CYP1A2 (0.67) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL1694959 0.83 CYP1A2 (0.65) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL1694961 0.83 CYP1A2 (0.65) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL10546754 0.83 ALDH1A1 (0.68) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL1694960 0.83 CYP1A2 (0.65) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL8805936 0.83 CYP1A2 (0.65) CYP1A2ALDH1A1TSHRMAPTTDP1
SCHEMBL27889633 0.83 ALDH1A1 (0.62) CYP1A2ALDH1A1TSHRTDP1HSD17B10
SCHEMBL9593320 0.82 CYP1A2 (0.51) CYP1A2ALDH1A1TSHRMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999065875-A1 TELOMERASE INHIBITORS GERON CORPORATION (US) 1999-12-23 WO claimed
CN-116640094-A Compounds as PRMT1 inhibitors and uses thereof 南京圣和药业股份有限公司 2023-08-25 CN disclosed
EP-3022182-A1 AMINOMETHYL-BIARYL DERIVATIVES AS COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF Novartis AG (CH) 2016-05-25 EP disclosed
CN-105555766-A Aminomethyl-biaryl derivatives as complement factor D inhibitors and uses thereof NOVARTIS AG 2016-05-04 CN disclosed
WO-2015009977-A1 AMINOMETHYL-BIARYL DERIVATIVES AS COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2015-01-22 WO disclosed
WO-2013093928-A1 AN IMPROVED PROCESS FOR PREPARING 2-OXINDOLES OF FORMULA I, A KEY RAW MATERIAL FOR MAKING PHARMACEUTICAL DRUGS AND INTERMEDIATES THEREOF ARCH PHARMALABS LIMITED (IN) 2013-06-27 WO disclosed
CN-102015688-A Muscarinic receptor agonists, compositions, methods of treatment thereof, and processes for preparation thereof ASTRAZENECA AB 2011-04-13 CN disclosed
EP-0706524-B1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 5- 2-(4-(BENZOISOTHIAZOL-3-YL)-PIPERAZIN-1-YL)ETHYL]-6-CHLORO-1,3-DIHYDRO-INDOL-2-ONE PFIZER (US) 2004-09-22 EP disclosed
EP-0850224-B1 RADIATION-ACTIVATED CYTOTOXIN THERAPY AUCKLAND UNISERVICES LTD (NZ) 2003-04-09 EP disclosed
US-6469181-B1 PREPARING 2-OXINDOLES AND N-HYROXY-2- OXINDOLES VIA REDUCTION OF 2-NITROARYLMALONATE DIESTERS WITHOUT ISOLATION OF INTERMEDIATES CATALYTICA, INC. 2002-10-22 US disclosed
EP-0809631-A4 PROCESS FOR PREPARING 2-OXINDOLES AND N-HYDROXY-2-OXINDOLES CATALYTICA INC (US) 1998-07-08 EP disclosed
EP-0850220-A1 CYCLOPROPYLINDOLES AND THEIR SECO PRECURSORS, AND THEIR USE AS PRODRUGS AUCKLAND DIVISION CANCER SOCIETY OF NEW ZEALAND INC. (NZ) 1998-07-01 EP disclosed
EP-0850224-A1 RADIATION-ACTIVATED CYTOTOXIN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 1998-07-01 EP disclosed
EP-0809631-A1 PROCESS FOR PREPARING 2-OXINDOLES AND N-HYDROXY-2-OXINDOLES CATALYTICA, INC. (US) 1997-12-03 EP disclosed
WO-1997007097-A1 CYCLOPROPYLINDOLES AND THEIR SECO PRECURSORS, AND THEIR USE AS PRODRUGS AUCKLAND DIVISION CANCER SOCIETY OF NEW ZEALAND INC. (NZ) 1997-02-27 WO disclosed
WO-1997007101-A1 RADIATION-ACTIVATED CYTOTOXIN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 1997-02-27 WO disclosed
WO-1996023770-A1 PROCESS FOR PREPARING 2-OXINDOLES AND N-HYDROXY-2-OXINDOLES CATALYTICA, INC. (US) 1996-08-08 WO disclosed
EP-0706524-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 5- 2-(4-(BENZOISOTHIAZOL-3-YL)-PIPERAZIN-1-YL)ETHYL]-6-CHLORO-1,3-DIHYDRO-INDOL-2-ONE PFIZER INC. (US) 1996-04-17 EP disclosed
WO-1995000510-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 5-[2-(4-(BENZOISOTHIAZOL-3-YL)-PIPERAZIN-1-YL)ETHYL]-6-CHLORO-1,3-DIHYDRO-INDOL-2-ONE PFIZER INC. (US) 1995-01-05 WO disclosed
US-5359068-A Processes and intermediates for the preparation of 5-[2-(4-(benzoisothiazol-3-yl)-piperazin-1-yl)ethyl]-6-chloro-1,3-dihydro-indol-2-one PFIZER INC. (US) 1994-10-25 US disclosed