SCHEMBL216113

SCHEMBL216113

O=C(CI)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
ALDH1A1 P00352 3/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CA1 P00915 1/20 0.50
MITF O75030 1/20 0.50
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
FFAR1 O14842 1/20 0.49
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
STAT3 P40763 1/20 0.48
HPGD P15428 1/20 0.47
RAB9A P51151 1/20 0.47
PTPN11 Q06124 1/20 0.47

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
SCHEMBL21765862 0.87 MEN1 (0.54) ALDH1A1MEN1KMT2AMITFPOLB
SCHEMBL30493065 0.87 MEN1 (0.43) CA12CA2CA9ALDH1A1CYP1A2
SCHEMBL18784389 0.84 ALDH1A1 (0.50) CA12CA2CA9ALDH1A1CYP1A2
SCHEMBL12263890 0.83 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AFFAR1HPGD
SCHEMBL17475956 0.82 MAPT (0.62) ALDH1A1MEN1KMT2APOLBGAA
SCHEMBL2843886 0.82 CA12 (0.56) CA12CA2CA9ALDH1A1CYP1A2
SCHEMBL9912437 0.82 CA12 (0.56) CA12CA2CA9ALDH1A1CYP1A2
SCHEMBL2688879 0.81 EPHX2 (0.61) ALDH1A1CYP1A2CYP2C9MEN1KMT2A
SCHEMBL9514416 0.81 CA2 (0.48) CA2ALDH1A1MEN1KMT2ACA1
SCHEMBL6691641 0.80 MITF (0.55) CA12CA2CA9ALDH1A1CYP1A2

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

Appears in 2494 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4393515-A1 ANTI-CLDN-18.2 ANTIBODY-DRUG CONJUGATE AND USE THEREOF Shanghai Junshi Biosciences Co., Ltd. (CN) 2024-07-03 EP claimed
US-12024565-B2 Targeted CD73 antibody and antibody-drug conjugate, and preparation method therefor and uses thereof FUDAN UNIVERSITY (CN) 2024-07-02 US claimed
EP-4386006-A1 ANTIBODY-DRUG CONJUGATE AND APPLICATION THEREOF Jiangsu Alphamab Biopharmaceuticals Co., Ltd. (CN) 2024-06-19 EP claimed
US-20240156978-A1 MAYTANSINE-ANTIBODY CONJUGATES AND METHODS OF USING SAME ANGIEX, INC. 2024-05-16 US claimed
WO-2024103007-A1 METHODS FOR DETECTING RNA AND MOLECULAR ANALYSIS IN THICK TISSUE SECTIONS THE JOHNS HOPKINS UNIVERSITY (US) 2024-05-16 WO claimed
EP-3218410-B1 ANTIBODY DRUG CONJUGATES NOVARTIS AG (CH) 2024-03-27 EP claimed
EP-3965887-B1 ANTIMICROBIAL CHITOSAN UNIV GENEVE (CH) 2024-02-28 EP claimed
US-20240043512-A1 EPITOPES OF ANTI-SERINE PROTEASE INHIBITOR KAZAL (SPIK) ANTIBODIES IMCARE BIOTECH LLC 2024-02-08 US claimed
EP-4313009-A1 MAYTANSINE-ANTIBODY CONJUGATES AND METHODS OF USING SAME Angiex, Inc. (US) 2024-02-07 EP claimed
US-20230372518-A1 ANTIMITOTIC TETRAPEPTIDE-ANTIBODY CONJUGATES AND METHODS OF USING SAME ANGIEX, INC. 2023-11-23 US claimed
US-5399501-A Covalent attachment of specific binding members to a solid phase with two bifunctional reagents and a dithio compound ABBOTT LABORATORIES (US) 1995-03-21 US claimed
WO-1994029333-A1 IMMUNOREACTIVE REAGENTS EMPLOYING MONOAMINE OXIDASE THE WELLCOME FOUNDATION LIMITED (GB) 1994-12-22 WO claimed
WO-1994020523-A1 TUMOR TARGETING WITH L-ENANTIOMERIC OLIGONUCLEOTIDE CONJUGATES OF IMMUNOREAGENTS AND OF CHELATED RADIONUCLIDES THE WELLCOME FOUNDATION LIMITED (GB) 1994-09-15 WO claimed
WO-1994013327-A1 IMMUNOREACTIVE REAGENTS EMPLOYING DIHYDROFOLATE REDUCTASE THE WELLCOME FOUNDATION LIMITED (GB) 1994-06-23 WO claimed
WO-1994012216-A1 SEQUENTIAL TARGETING OF TUMOR SITES WITH OLIGONUCLEOTIDE CONJUGATES OF ANTIBODY AND COMPLEMENTARY OLIGONUCLEOTIDE CONJUGATES OF CHELATED RADIONUCLIDE THE WELLCOME FOUNDATION LIMITED (GB) 1994-06-09 WO claimed
EP-0366770-B1 LIPOSOMES COUPLED TO HORMONES VESTAR INC (US) 1994-02-09 EP claimed
EP-0196669-B1 IMPROVED METHOD OF CONJUGATING METALLOTHIONEIN TO BIOLOGICALLY ACTIVE MOLECULES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-02-12 EP claimed
EP-0396116-A2 Covalent attachment of specific binding members to a solid phase ABBOTT LABORATORIES (US) 1990-11-07 EP claimed
US-4657853-A Immunoassays utilizing covalent conjugates of polymerized enzyme and antibody E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-04-14 US claimed
EP-0175560-A2 Immunoassays utilizing covalent conjugates of polymerized enzyme and antibody E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-03-26 EP claimed