SCHEMBL6074049

SCHEMBL6074049

ClOC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
KIF11 P52732 1/20 0.44
MAPK1 P28482 1/20 0.42
KCNN4 O15554 5/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 1/20 0.39
ALOX15 P16050 1/20 0.39
ORAI1 Q96D31 1/20 0.33
ORAI2 Q96SN7 1/20 0.33
ORAI3 Q9BRQ5 1/20 0.33
TRPV6 Q9H1D0 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
PTPN1 P18031 1/20 0.32
ESR1 P03372 1/20 0.32
CYP3A4 P08684 1/20 0.32
ESR2 Q92731 1/20 0.32

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
SCHEMBL27565399 0.79 KCNN4 (0.53) TSHRKIF11MAPK1KCNN4ALDH1A1
SCHEMBL297786 0.75 MAPK1 (0.52) TSHRKIF11MAPK1KCNN4ALDH1A1
SCHEMBL8973 0.75 KIF11 (0.48) TSHRKIF11MAPK1KCNN4ALDH1A1
Fluoride SCHEMBL27919232 0.73 KIF11 (0.46) TSHRKIF11MAPK1KCNN4ALDH1A1
SCHEMBL28297324 0.73 KIF11 (0.46) TSHRKIF11MAPK1KCNN4ALDH1A1
Ammonia Solution, Strong SCHEMBL23726528 0.73 KIF11 (0.46) TSHRKIF11MAPK1KCNN4ALDH1A1
Hydrochloric Acid SCHEMBL28556207 0.73 KIF11 (0.46) TSHRKIF11MAPK1KCNN4ALDH1A1
Bromide SCHEMBL28557682 0.73 KIF11 (0.46) TSHRKIF11MAPK1KCNN4ALDH1A1
SCHEMBL16323365 0.72 TSHR (0.50) TSHRKIF11MAPK1KCNN4ALDH1A1
SCHEMBL11558547 0.71 MAPK1 (0.48) TSHRKIF11MAPK1KCNN4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1447408-A1 Amino acid loaded trityl alcohol resins, method of production of amino acid loaded trityl alcohol resins and therapeutics produced therewith Rohm and Haas Company (US) 2004-08-18 EP claimed
US-20040158037-A1 Amino acid loaded trityl alcohol resins, method of production of amino acid loaded trityl alcohol resins and biologically active substances and therapeutics produced therewith BOHLING JAMES CHARLES (US) 2004-08-12 US claimed
CN-114008058-B Prodrugs of CDK inhibitors for the treatment of cancer 润佳(苏州)医药科技有限公司 2024-07-05 CN disclosed
CN-113993899-B anti-CD 47 antibodies and uses thereof 乐普生物科技股份有限公司 2024-03-29 CN disclosed
CN-114008058-A Prodrugs of CDK inhibitors for the treatment of cancer 润佳(苏州)医药科技有限公司 2022-02-01 CN disclosed
CN-113993899-A anti-CD 47 antibodies and uses thereof 乐普生物科技股份有限公司 2022-01-28 CN disclosed
US-7049394-B2 Method for preparing free flow resin ROHM AND HAAS COMPANY (US) 2006-05-23 US disclosed
EP-0781128-B1 CLOTRIMAZOLE METABOLITES IN THE TREATMENT OF SICKLE CELL DISEASE CHILDRENS MEDICAL CENTER (US) 2005-11-23 EP disclosed
US-20050256298-A1 Method for preparing free flow resin MAIKNER JOHN J 2005-11-17 US disclosed
US-20040209999-A1 Method of manufacturing polypeptides, including T-20 and T-1249, at commercial scale, and polypeptide compositions related thereto BOHLING JAMES CHARLES (US) 2004-10-21 US disclosed
EP-1452538-A1 Method of manufacturing T-20 and T-1249 peptides at commercial scale, and T-20 and T-1249 compositions related thereto ROHM AND HAAS COMPANY (US) 2004-09-01 EP disclosed
EP-1447408-A1 Amino acid loaded trityl alcohol resins, method of production of amino acid loaded trityl alcohol resins and therapeutics produced therewith Rohm and Haas Company (US) 2004-08-18 EP disclosed
US-20040158037-A1 Amino acid loaded trityl alcohol resins, method of production of amino acid loaded trityl alcohol resins and biologically active substances and therapeutics produced therewith BOHLING JAMES CHARLES (US) 2004-08-12 US disclosed
US-20040106774-A1 Method for preparing free flow resin ROHM AND HAAS COMPANY 2004-06-03 US disclosed
EP-1391477-A1 Method for preparing free flow resin ROHM AND HAAS COMPANY (US) 2004-02-25 EP disclosed
EP-0781128-A2 CLOTRIMAZOLE METABOLITES IN THE TREATMENT OF SICKLE CELL DISEASE CHILDREN'S MEDICAL CENTER CORPORATION (US) 1997-07-02 EP disclosed
WO-1996008242-A9 CLOTRIMAZOLE METABOLITES IN THE TREATMENT OF SICKLE CELL DISEASE 1996-06-27 WO disclosed
WO-1996008242-A2 CLOTRIMAZOLE METABOLITES IN THE TREATMENT OF SICKLE CELL DISEASE CHILDREN'S MEDICAL CENTER CORPORATION (US) 1996-03-21 WO disclosed