SCHEMBL6903932

SCHEMBL6903932

ClC(Br)CCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
CASP1 P29466 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ANPEP P15144 2/20 0.42
ERAP1 Q9NZ08 2/20 0.42
ERAP2 Q6P179 1/20 0.42
CYP2A6 P11509 1/20 0.42
HTR2A P28223 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
ACP3 P15309 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 2/20 0.40

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
SCHEMBL8378873 0.81 TDP1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL9819003 0.80 HTR2A (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL4237177 0.80 ALDH1A1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL4192867 0.80 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL29187623 0.80 ALDH1A1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL4798497 0.80 TDP1 (0.52) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL4377949 0.76 ANPEP (0.52) ALDH1A1HPGDALOX15ALOX12CASP1
SCHEMBL21582183 0.76 ALDH1A1 (0.44) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL4011582 0.76 TDP1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12
SCHEMBL3791903 0.76 TDP1 (0.48) TDP1ALDH1A1HPGDALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116751105-A Preparation method of 4-bromocyclopropylbenzene 爱斯特(成都)生物制药股份有限公司 2023-09-15 CN claimed
CN-116751105-B Preparation method of 4-bromocyclopropylbenzene 爱斯特(成都)生物制药股份有限公司 2026-03-31 CN disclosed
CN-116751105-A Preparation method of 4-bromocyclopropylbenzene 爱斯特(成都)生物制药股份有限公司 2023-09-15 CN disclosed
CN-116751105-A Preparation method of 4-bromocyclopropylbenzene 爱斯特(成都)生物制药股份有限公司 2023-09-15 CN disclosed
CN-110294680-A A kind of preparation method in levels Moses spit of fland 北京深蓝海生物医药科技有限公司 2019-10-01 CN disclosed
EP-1425002-A1 ARYLOXYPROPYLAMINES AS CHEMOSENSITIZING AGENTS IN THE TREATMENT OF CANCER Ramot at Tel Aviv University Ltd. (IL) 2004-06-09 EP disclosed
WO-2003022258-A1 ARYLOXYPROPYLAMINES AS CHEMOSENSITIZING AGENT IN THE TREATMENT OF CANCER RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2003-03-20 WO disclosed
US-4957934-A AROMATASE INHIBITORS, TREATMENT OF STEROID HORMONE DEPENDENT DISEASES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-09-18 US disclosed
EP-0004447-A2 Preparation of trifluoromethylphenols and novel trifluoromethylphenyl benzyl ether intermediates ELI LILLY AND COMPANY (US) 1979-10-03 EP disclosed