SCHEMBL271715

SCHEMBL271715

Brc1cnc2ccccc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.59
CYP1A2 P05177 1/20 0.57
PDGFRB P09619 3/20 0.50
PDGFRA P16234 3/20 0.50
ALPL P05186 1/20 0.50
MGAM O43451 1/20 0.50
KDR P35968 1/20 0.49
ALDH1A1 P00352 3/20 0.48
GLA P06280 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ACHE P22303 1/20 0.48
CYP2A6 P11509 2/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.45
GPR3 P46089 1/20 0.45
EGFR P00533 1/20 0.45
PIK3CD O00329 1/20 0.44

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
Bromide SCHEMBL7788733 0.98 BIRC5 (0.58) BIRC5CYP1A2PDGFRBPDGFRAALPL
Quinoline SCHEMBL28218277 0.90 ALDH1A1 (0.63) BIRC5CYP1A2PDGFRBPDGFRAALPL
Acetic Acid SCHEMBL28150882 0.87 MGAM (0.57) BIRC5CYP1A2PDGFRBPDGFRAALPL
SCHEMBL4709550 0.86 BIRC5 (0.51) BIRC5CYP1A2PDGFRBPDGFRAALPL
SCHEMBL6584312 0.84 BIRC5 (0.46) BIRC5CYP1A2PDGFRBPDGFRAALPL
SCHEMBL439774 0.79 ALPL (0.43) BIRC5CYP1A2PDGFRBPDGFRAALPL
SCHEMBL3822492 0.79 BIRC5 (0.71) BIRC5CYP1A2PDGFRBPDGFRAKDR
SCHEMBL20528292 0.79 BACE1 (0.47) BIRC5CYP1A2ALDH1A1MAPTCYP2A6
SCHEMBL31106407 0.78 BIRC5 (0.47) BIRC5CYP1A2PDGFRBPDGFRAMGAM
SCHEMBL24871233 0.78 BIRC5 (0.70) BIRC5CYP1A2PDGFRBPDGFRACYP2A6

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 2557 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116943730-B Method for preparing cyclic amine compound by catalyzing hydrogenation of pyridine and quinoline compound 浙江大学 2025-04-11 CN claimed
CN-119757573-A High-coverage analysis method for carbonyl compounds in white spirit and application thereof 贵州习酒股份有限公司 2025-04-04 CN claimed
CN-119707923-A Derivatization reagent and application thereof in method for identifying amino metabolites 中国科学院大连化学物理研究所 2025-03-28 CN claimed
CN-117205211-B Application of quinoline compound in preparation of fish parasitic protozoan resisting medicine 西北农林科技大学深圳研究院 2024-04-05 CN claimed
CN-117205211-A Application of quinoline compound in preparation of fish parasitic protozoan resisting medicine 西北农林科技大学深圳研究院 2023-12-12 CN claimed
CN-116943730-A Method for preparing cyclic amine compound by catalyzing hydrogenation of pyridine and quinoline compound 浙江大学 2023-10-27 CN claimed
CN-109776406-B Method for cross coupling of ether compound and quinoline derivative 湘潭大学 2021-05-04 CN claimed
CN-110724047-B Method for preparing aromatic carboxylic acid compound 中国科学院大连化学物理研究所 2020-10-30 CN claimed
CN-110724047-A Method for preparing aromatic carboxylic acid compound 中国科学院大连化学物理研究所 2020-01-24 CN claimed
CN-110229102-A 2- is alkylated quinoline, derivative and its synthetic method 湘潭大学 2019-09-13 CN claimed
WO-2004013072-A2 COPPER CATALYZED ARYLATION RHODIA PHARMA SOLUTIONS INC. (US) 2004-02-12 WO claimed
US-20030125531-A1 Arylation method for the functionalization of O-allyl erythromycin derivatives ABBVIE INC. 2003-07-03 US claimed
WO-2002096922-A1 AN ARYLATION METHOD FOR THE FUNCTIONALIZATION OF O-ALLYL ERYTHROMYCIN DERIVATIVES ABBOTT LABORATORIES (US) 2002-12-05 WO claimed
US-6289286-B1 Surface regeneration of biosensors and characterization of biomolecules associated therewith BIACORE AB (SE) 2001-09-11 US claimed
EP-1082607-A1 SURFACE REGENERATION OF BIOSENSORS Biacore AB (SE) 2001-03-14 EP claimed
WO-1999063333-A1 SURFACE REGENERATION OF BIOSENSORS BIACORE AB (SE) 1999-12-09 WO claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
CN-1043717-A Cephalosporin compound TANABE SEIYAKU CO (JP) 1990-07-11 CN claimed