SCHEMBL3472843

SCHEMBL3472843

O=C(CF)Nc1ccc(Br)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.73
MEN1 O00255 4/20 0.73
HPGD P15428 2/20 0.59
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 2/20 0.54
LMNA P02545 2/20 0.54
ALDH1A1 P00352 4/20 0.54
POLB P06746 2/20 0.54
MAPT P10636 2/20 0.54
ALOX12 P18054 1/20 0.53
KDM4E B2RXH2 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
F13A1 P00488 1/20 0.50
TGM2 P21980 1/20 0.50
TGM1 P22735 1/20 0.50

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
SCHEMBL13439711 0.86 KMT2A (0.71) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL22397597 0.86 KMT2A (0.70) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL16140981 0.85 KMT2A (1.00) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL1134070 0.81 CYP1A1 (0.60) KMT2AMEN1ALDH1A1POLBMAPT
SCHEMBL9843748 0.81 GAA (0.66) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL1039601 0.81 KMT2A (0.76) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL5271791 0.81 KMT2A (0.76) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL7934465 0.79 KMT2A (0.73) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL7445670 0.79 KMT2A (0.73) KMT2AMEN1HPGDNPC1RAB9A
SCHEMBL5597893 0.79 KMT2A (0.73) KMT2AMEN1HPGDNPC1RAB9A

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114544785-B Flurbiprofen and detection method of impurities thereof 远大生命科学(鞍山)有限公司 2024-06-21 CN claimed
CN-114544785-A Method for detecting flurbiprofen and impurities thereof 远大生命科学(辽宁)有限公司 2022-05-27 CN claimed
CN-112827368-A Anti-pollution reverse osmosis membrane and preparation method thereof 中化(宁波)润沃膜科技有限公司 2021-05-25 CN claimed
CN-114544785-B Flurbiprofen and detection method of impurities thereof 远大生命科学(鞍山)有限公司 2024-06-21 CN disclosed
CN-117705995-A Analysis method of flurbiprofen related substances 浙江东亚药业股份有限公司 2024-03-15 CN disclosed
CN-117705852-A Method for measuring ethyl 2- (4-bromo-3-fluorophenyl) acetate content by nuclear magnetic resonance fluorine spectrum 南京药石科技股份有限公司 2024-03-15 CN disclosed
CN-112827368-B Anti-pollution reverse osmosis membrane and preparation method thereof 中化(宁波)润沃膜科技有限公司 2023-08-11 CN disclosed
CN-114544785-A Method for detecting flurbiprofen and impurities thereof 远大生命科学(辽宁)有限公司 2022-05-27 CN disclosed
CN-112827368-A Anti-pollution reverse osmosis membrane and preparation method thereof 中化(宁波)润沃膜科技有限公司 2021-05-25 CN disclosed
EP-2940000-B1 PROCESS FOR PREPARING METHYL ACETATE DALIAN INST CHEMICAL PHYSICS CAS (CN) 2017-10-18 EP disclosed
US-9440226-B2 Method for preparing methyl acetate DALIAN INSTITUTE OF CHEMICAL PHYSICS, CHINESE ACADEMY OF SCIENCES (CN) 2016-09-13 US disclosed
WO-2000027853-A1 HYDROBORONATION PROCESS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2000-05-18 WO disclosed
US-6034275-A FUGICIDES; ATICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 2000-03-07 US disclosed
EP-0638566-B1 5-Aminoflavone derivatives, their preparation and their use as antibacterial, anti-estrogenic and/or antitumor agent KYOWA HAKKO KOGYO KK (JP) 1999-01-07 EP disclosed
EP-0778264-A1 Tertiary amines having antimycotic and cholesterol lowering activity F. HOFFMANN-LA ROCHE AG (CH) 1997-06-11 EP disclosed
US-5539112-A 5-aminoflavone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-07-23 US disclosed
EP-0638566-A1 5-Aminoflavone derivatives, their preparation and their use as antibacterial, anti-estrogenic and/or antitumor agent KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-02-15 EP disclosed
EP-0347227-B1 Pesticidal compositions DU PONT (US) 1993-11-24 EP disclosed
US-5135744-A PALATABLE SOLID PESTICIDAL COMPOSITIONS OF ETHYLENE AND VINYL ACETATE COPOLYMER E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-04 US disclosed
EP-0347227-A1 Pesticidal compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-12-20 EP disclosed