SCHEMBL33952

SCHEMBL33952

Clc1ccccc1[C](c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
CES2 O00748 2/20 0.52
CES1 P23141 2/20 0.52
SMO Q99835 1/20 0.48
POLB P06746 2/20 0.46
HPGD P15428 2/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KCNK3 O14649 1/20 0.44
KCNK9 Q9NPC2 1/20 0.44
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
TSHR P16473 3/20 0.43

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
SCHEMBL374630 0.95 ALDH1A1 (0.56) ALDH1A1CES2CES1SMOPOLB
SCHEMBL3138767 0.93 CES2 (0.54) ALDH1A1CES2CES1SMOPOLB
SCHEMBL4416667 0.84 CES2 (0.62) ALDH1A1CES2CES1POLBHPGD
SCHEMBL8797736 0.78 ALDH1A1 (0.54) ALDH1A1CES2CES1SMOPOLB
SCHEMBL374631 0.78 SMN1; SMN2 (0.55) ALDH1A1CES2CES1HPGDNPC1
SCHEMBL49873 0.76 KMT2A (0.65) ALDH1A1CES2CES1SMOPOLB
SCHEMBL20659154 0.76 ALDH1A1 (0.52) ALDH1A1CES2CES1SMOPOLB
SCHEMBL29434816 0.76 KMT2A (0.65) ALDH1A1CES2CES1SMOPOLB
SCHEMBL9577479 0.76 CYP19A1 (0.46) ALDH1A1CES2CES1HPGDNPC1
SCHEMBL5623439 0.75 ALDH1A1 (0.46) ALDH1A1CES2CES1GAAKCNK3

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 7245 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324658-A High-yield o-chlorobenzonitrile and production process thereof 莘县正升化工有限公司 2024-07-12 CN claimed
CN-118307627-A Epoxy ketone-containing cyclopeptide compound, and preparation method and application thereof 浙大城市学院 2024-07-09 CN claimed
CN-118290429-A Preparation method of non-zolpidem intermediate and non-zolpidem 山东百诺医药股份有限公司 2024-07-05 CN claimed
EP-4392071-A1 METHOD OF SYNTHESIZING DENDRIMERIC AMPHIPHILE Kaohsiung Medical University (TW) 2024-07-03 EP claimed
CN-113735927-B Nucleotide analogue and preparation method and application thereof 厦门蔚扬药业有限公司 2024-06-28 CN claimed
US-20240209009-A1 PEPTIDES COMPRISING A PHOSPHORYLCHOLINE CONJUGATE AND METHODS OF SYNTHESIZING SAME TARSIER PHARMA LTD. (IL) 2024-06-27 US claimed
WO-2024134676-A1 PROCESS FOR THE PREPARATION OF TIRZEPATIDE DR. REDDY’S LABORATORIES LIMITED (IN) 2024-06-27 WO claimed
US-20240199687-A1 SUBSTITUTION OF HISTIDINE WITH 2-THIOHISTIDINE IN BIOACTIVE PEPTIDES UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE 2024-06-20 US claimed
WO-2024110477-A2 SYNTHESIS OF A CYCLIC PEPTIDE JANSSEN PHARMACEUTICA NV (BE) 2024-05-30 WO claimed
CN-118063540-A Solid-phase polypeptide synthesis method based on aqueous phase 国科大杭州高等研究院 2024-05-24 CN claimed
EP-0953577-A1 Procedure for obtaining the somatostatin analog, octreotide Lipotec, S.A. (ES) 1999-11-03 EP claimed
WO-1999043701-A2 PEPTIDES FOR INHIBITION OF APOPTOSIS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NST NEUROSURVIVAL TECHNOLOGIES LTD. (IL) 1999-09-02 WO claimed
WO-1999043694-A1 IMPROVED METHODS FOR SYNTHESIS OF OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1999-09-02 WO claimed
EP-0934076-A1 SOLID PHASE LIPOGLYCOPEPTIDE LIBRARY, COMPOSITIONS AND METHODS Intercardia, Inc. (US) 1999-08-11 EP claimed
EP-0934076-A4 1999-08-11 EP claimed
US-5817811-A AMIDATION OF THE CORRESPOND ESTERIFIED AMINE COMPOUND WITH A CARBOXYLATED NUCLEOTIDE BASE HOECHST AKTIENGESELLSCHAFT (DE) 1998-10-06 US claimed
WO-1997034623-A1 SOLID PHASE LIPOGLYCOPEPTIDE LIBRARY, COMPOSITIONS AND METHODS TRANSCELL TECHNOLOGIES, INC. (US) 1997-09-25 WO claimed
EP-0761681-A2 Process for the preparation of substituted derivatives of N-ethylglycine HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-12 EP claimed
EP-0730605-A1 SUBSTITUTED DI- AND TRIPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1996-09-11 EP claimed
WO-1995012612-A1 SUBSTITUTED DI- AND TRIPEPTIDE INHIBITORS OF PROTEIN:FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1995-05-11 WO claimed