SCHEMBL329145

SCHEMBL329145

O=C(O)[C@H](CC[C@@H](C(=O)O)N(O)c1ccccc1)N(O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.41
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.37
SRC P12931 1/20 0.37
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL329144 1.00 NPSR1 (0.41) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL9283953 0.88 NPSR1 (0.41) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL9283942 0.88 NPSR1 (0.41) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL29442908 0.86 NPSR1 (0.40) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL5595916 0.86 KMT2A (0.41) NPSR1KMT2ALMNASMN1; SMN2CYP1A2
SCHEMBL5595913 0.86 KMT2A (0.41) NPSR1KMT2ALMNASMN1; SMN2CYP1A2
SCHEMBL27526065 0.84 CPA1 (0.43) NPSR1ALDH1A1KMT2ANPC1POLB
Sulfuric Acid SCHEMBL9194283 0.82 BLM (0.41) ALDH1A1TSHRLMNACYP3A4HSP90AA1
SCHEMBL5596590 0.81 CYP2C19 (0.39) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL5596586 0.81 CYP2C19 (0.39) NPSR1ALDH1A1KMT2ANPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541344-B2 Compositions with cyclopropenes and metal-complexing agents ROHM AND HAAS COMPANY (US) 2013-09-24 US claimed
US-20090061052-A1 Casings for Foodstuffs RED ARROW PRODUCTS CO., LLC. (US) 2009-03-05 US claimed
EP-1011131-B1 Methods for enhancing the metal removal rate during the chemical-mechanical polishing process of a semiconductor INFINEON TECHNOLOGIES AG (DE) 2007-07-25 EP claimed
EP-1368042-A4 HAIR RELAXER SYSTEM AND METHOD THEREFOR AVLON IND INC (US) 2005-09-07 EP claimed
EP-1368042-A2 HAIR RELAXER SYSTEM AND METHOD THEREFOR AVLON INDUSTRIES INC. (US) 2003-12-10 EP claimed
US-6602493-B2 Prevention deposits of metal compound on hair; applying base, then removal with chelate compound AVLON INDUSTRIES, INC. 2003-08-05 US claimed
EP-0873106-B1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING & MFG (US) 2003-05-02 EP claimed
US-20030049222-A1 Hair relaxer system and method therefor AVLON INDUSTRIES, INC., AN ILLINOIS CORPORATION 2003-03-13 US claimed
WO-2002065982-A2 HAIR RELAXER SYSTEM AND METHOD THEREFOR AVLON INDUSTRIES, INC. (US) 2002-08-29 WO claimed
US-6391286-B1 CURABLE DENTAL COMPOSITION COMPRISING PREFORMED METAL COMPLEX AS FLUORIDE RELEASING MATERIAL 3M INNOVATIVE PROPERTIES COMPANY 2002-05-21 US claimed
US-6136714-A Methods for enhancing the metal removal rate during the chemical-mechanical polishing process of a semiconductor SIEMENS AKTIENGESELLSCHAFT (DE) 2000-10-24 US claimed
EP-1011131-A1 Methods for enhancing the metal removal rate during the chemical-mechanical polishing process of a semiconductor SIEMENS AKTIENGESELLSCHAFT (DE) 2000-06-21 EP claimed
EP-0873106-A1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-10-28 EP claimed
WO-1997018791-A1 USE OF METALLOFLUOROCOMPLEXES FOR DENTAL COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-05-29 WO claimed
EP-0386886-A1 Deicing compositions comprising calcium magnesium acetate and chelating agent GENERAL ATOMICS INTERNATIONAL SERVICES CORPORATION (US) 1990-09-12 EP claimed
US-4377625-A AMINOCARBOXYLIC ACID, POLYAMINE OR AMINOALCOHOL CHELATING AGENT DURACELL INC. (US) 1983-03-22 US claimed
EP-4629967-A1 PERFLUORINATED MICELLES AND MEDICAL USES THEREOF Commissariat à l'Energie Atomique et aux Energies Alternatives (FR) 2025-10-15 EP disclosed
WO-2025080785-A1 METHODS AND MOLECULAR CONSTRUCTS FOR INCORPORATING MOLECULES INTO ELECTRICAL CIRCUITS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2025-04-17 WO disclosed
EP-0198765-A2 Preparation of liposomes GEORGETOWN UNIVERSITY (US) 1986-10-22 EP disclosed
US-4377625-A AMINOCARBOXYLIC ACID, POLYAMINE OR AMINOALCOHOL CHELATING AGENT DURACELL INC. (US) 1983-03-22 US disclosed