SCHEMBL8629943

SCHEMBL8629943

Cc1cc(OC(F)F)nc(-c2ccccc2NC(=O)O)n1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.50
TSHR P16473 5/20 0.44
NPSR1 Q6W5P4 3/20 0.44
MAPK1 P28482 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
LMNA P02545 3/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 2/20 0.40
NPC1 O15118 1/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL8629039 0.92 HTT (0.40) MAPTTSHRNPSR1HTTALDH1A1
SCHEMBL8626823 0.89 MAPT (0.64) MAPTTSHRNPSR1MAPK1L3MBTL1
SCHEMBL8540029 0.85 MAPT (0.48) MAPTTSHRNPSR1MAPK1L3MBTL1
SCHEMBL8628783 0.83 RAB9A (0.49) MAPTTSHRNPSR1MAPK1L3MBTL1
SCHEMBL8629522 0.80 MAPT (0.46) MAPTTSHRNPSR1MAPK1L3MBTL1
SCHEMBL5193130 0.78 MAPT (0.48) MAPTL3MBTL1LMNAHTTALDH1A1
SCHEMBL8629851 0.77 KMT2A (0.60) MAPTTSHRNPSR1MAPK1L3MBTL1
SCHEMBL8630926 0.76 MAPT (0.40) MAPTTSHRNPSR1MAPK1L3MBTL1
SCHEMBL8627539 0.74 SLC2A1 (0.49) MAPTTSHRNPSR1MAPK1LMNA
SCHEMBL8628976 0.74 ALDH1A1 (0.47) MAPTTSHRNPSR1L3MBTL1LMNA

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
US-5847126-A N-azinyl-N'-(het) arylsulphonyl-ureas BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0645386-B1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1997-12-29 EP disclosed
US-5696257-A INTERMEDIATES FOR HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-09 US disclosed
US-5580842-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-12-03 US disclosed
US-5476936-A Herbicides BAYER AKTIENGESELLSCHAFT (DE) 1995-12-19 US disclosed
EP-0645386-A1 N-Azinyl-N'-(het)arylsulfonylureas as herbicides BAYER AG (DE) 1995-03-29 EP disclosed
EP-0097122-B1 N-HETEROCYCLOSULFONYL-N'-PYRIMIDINYL AND TRIAZINYL UREAS CIBA-GEIGY AG (CH) 1989-05-31 EP disclosed
US-4549898-A PREEMERGENT AND POSTEMERGENT HERBICIDES CIBA-GEIGY CORPORATION (US) 1985-10-29 US disclosed
EP-0097122-A2 N-heterocyclosulfonyl-N'-pyrimidinyl and triazinyl ureas CIBA-GEIGY AG (CH) 1983-12-28 EP disclosed