SCHEMBL104419

SCHEMBL104419

O=C(Cl)c1cccc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.65
ERCC5 P28715 1/20 0.53
FEN1 P39748 1/20 0.53
ALDH1A1 P00352 2/20 0.52
TSHR P16473 1/20 0.52
KCNK3 O14649 1/20 0.50
KCNK9 Q9NPC2 1/20 0.50
GRM5 P41594 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
KCNQ3 O43525 1/20 0.49
KCNQ2 O43526 1/20 0.49
KCNE1 P15382 1/20 0.49
KCNQ1 P51787 1/20 0.49
KCNMA1 Q12791 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48

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
SCHEMBL29637481 1.00 PARP1 (0.65) PARP1ERCC5FEN1ALDH1A1TSHR
Trimethylammonium SCHEMBL28285756 0.92 ALDH1A1 (0.57) PARP1ERCC5FEN1ALDH1A1TSHR
SCHEMBL27510 0.85 ALDH1A1 (0.59) PARP1ALDH1A1TSHRL3MBTL1PKM
SCHEMBL3169530 0.83 PARP1 (0.68) PARP1ERCC5FEN1ALDH1A1KCNK3
SCHEMBL3173817 0.83 PARP1 (0.68) PARP1ERCC5FEN1ALDH1A1KCNK3
SCHEMBL2107465 0.82 KCNK3 (0.74) KCNK3KCNK9KCNQ3KCNQ2KCNE1
Hydrochloric Acid SCHEMBL8084573 0.82 ALDH1A1 (0.57) PARP1ALDH1A1TSHRL3MBTL1PKM
Bromide SCHEMBL31026552 0.82 ALDH1A1 (0.57) PARP1ALDH1A1TSHRL3MBTL1PKM
Iodide SCHEMBL29916276 0.82 ALDH1A1 (0.57) PARP1ALDH1A1TSHRL3MBTL1PKM
Benzene SCHEMBL9243917 0.82 ALDH1A1 (0.57) PARP1ALDH1A1TSHRHPGDL3MBTL1

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 3471 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743438-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2026-05-20 EP claimed
EP-4665705-A1 A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2025-12-24 EP claimed
US-12390499-B2 Bacteriophage for modulating inflammatory bowel disease KEIO UNIVERSITY (JP) 2025-08-19 US claimed
CN-120142503-A Method for detecting related substances of 4-chlorobenzoyl chloride 河北广祥制药有限公司 2025-06-13 CN claimed
WO-2025068995-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2025-04-03 WO claimed
EP-3431544-B1 COMPOSITION FOR PREPARING A FOAM, FOAM, AND SHOE EMPLOYING THE SAME TSRC CORP (TW) 2025-02-26 EP claimed
CN-118812350-A Method for synthesizing m-chlorobenzoyl chloride from m-chlorotoluene 江苏聚由新材料科技有限公司 2024-10-22 CN claimed
US-20240287008-A1 METHOD FOR THE SYNTHESIS OF 3-R-1,4,2-DIOXAZOL-5-ONES PANASONIC HOLDINGS CORPORATION (JP) 2024-08-29 US claimed
WO-2024171098-A1 A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2024-08-22 WO claimed
US-11981648-B2 Method for the synthesis of 3-R-1,4,2-dioxazol-5-ones TESLA, INC. (US) 2024-05-14 US claimed
EP-0639559-B1 Preparation of 1,2-diacyl-2-(t-alkyl)hydrazines ROHM & HAAS (US) 1997-10-15 EP claimed
EP-0639559-A1 Preparation of 1,2-diacyl-2-(t-alkyl)hydrazines ROHM AND HAAS COMPANY (US) 1995-02-22 EP claimed
WO-1993014055-A1 PREPARATION OF 2,5-DICHLOROBENZOPHENONES MAXDEM INCORPORATED (US) 1993-07-22 WO claimed
US-5210313-A Friedel crafts aryloylation of 1,4-dichlorobenzene and Lewis acids MAXDEM INCORPORATED (US) 1993-05-11 US claimed
US-4470930-A Preparation of nuclear chlorinated aromatic compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1984-09-11 US claimed
US-4284584-A REACTING AN ANHYDRIDE WITH AN ALKALI METAL CYANIDE BAYER AKTIENGESELLSCHAFT (DE) 1981-08-18 US claimed
US-4190600-A IRON/III/ CHLORIDE OR BROMIDE HALOGENATION CATALYST WITH SULFUR COCATALYST HOECHST AKTIENGESELLSCHAFT (DE) 1980-02-26 US claimed
US-4123447-A REACTING (1,5-CYCLOOCTADIENE)BIS(TRIETHYLPHOSPHINE)-NICKEL(O) WITH AN ACYL HALIDE, OLIGOMERIZATION CATALYSTS PHILLIPS PETROLEUM COMPANY (US) 1978-10-31 US claimed
US-4117006-A SOLVENT-FREE GAF CORPORATION (US) 1978-09-26 US claimed
US-3996274-A SOLVENT-FREE, FERRIC CHLORIDE-IODINE CATALYST MOBIL OIL CORPORATION (US) 1976-12-07 US claimed