SCHEMBL8209484

SCHEMBL8209484

CCCCNC(=O)CNC

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.52
EPHX1 P07099 4/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CNR1 P21554 1/20 0.49
NAAA Q02083 1/20 0.48
ACHE P22303 1/20 0.47
MMP2 P08253 1/20 0.47
LPAR1 Q92633 1/20 0.46
HPGD P15428 1/20 0.46
FAAH O00519 2/20 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
SCHEMBL19606563 0.93 CASP2 (0.61) CASP2EPHX1MEN1KMT2ANAAA
SCHEMBL21613628 0.91 CASP2 (0.64) CASP2EPHX1MEN1KMT2ANAAA
SCHEMBL22340820 0.91 CASP2 (0.64) CASP2EPHX1MEN1KMT2ANAAA
SCHEMBL11014644 0.91 CASP2 (0.64) CASP2EPHX1MEN1KMT2ANAAA
SCHEMBL25950981 0.91 CASP2 (0.64) CASP2EPHX1MEN1KMT2ANAAA
SCHEMBL12686586 0.86
SCHEMBL25091844 0.85 CASP2 (0.68) CASP2MEN1KMT2ACNR1NAAA
SCHEMBL19401722 0.84 MEN1 (0.46) CASP2MEN1KMT2ACNR1NAAA
SCHEMBL25140466 0.84 MEN1 (0.52) CASP2EPHX1MEN1KMT2ANAAA
SCHEMBL25449079 0.83 EPHX2 (0.65) CNR1LPAR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023205595-A2 EGFR INHIBITORS IN CANCER TREATMENT CELYN THERAPEUTICS, INC (US) 2023-10-26 WO disclosed
EP-4227315-A1 COMPOUND TARGETING PROSTATE SPECIFIC MEMBRANE ANTIGEN, AND PREPARATION METHOD THEREFOR AND USE THEREOF Yantai Lannacheng Biotechnology Co., Ltd. (CN) 2023-08-16 EP disclosed
WO-2022140554-A1 SMALL MOLECULE DEGRADERS OF PHOSPHATIDYLINOSITOL-5-PHOSPHATE 4-KINASE TYPE 2 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-30 WO disclosed
EP-3922632-A1 TARGET PROTEIN EED DEGRADATION-INDUCING DEGRADUCER, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES RELATED TO EED, EZH2, OR PRC2, COMPRISING SAME AS ACTIVE INGREDIENT Korea Research Institute of Chemical Technology (KR) 2021-12-15 EP disclosed
WO-2008042480-A2 EPOXIDE INHIBITORS OF CYSTEINE PROTEASES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2008-04-10 WO disclosed
US-20070224273-A1 Multifunctional Supramolecular Hydrogels as Biomaterials THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (HK) 2007-09-27 US disclosed
US-3969087-A Gels of nonpolar liquids with N-acyl amino acids and derivatives thereof as gelling agents AJINOMOTO CO., LTD. (JA) 1976-07-13 US disclosed