SCHEMBL7537868

SCHEMBL7537868

Cc1c(C(F)(F)F)cnn(-c2ccc(Cl)cc2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.48
SMN1; SMN2 Q16637 7/20 0.48
NPC1 O15118 6/20 0.48
LMNA P02545 3/20 0.48
GRM1 Q13255 2/20 0.46
NPBWR1 P48145 5/20 0.45
MCHR1 Q99705 3/20 0.45
ALDH1A1 P00352 4/20 0.43
MAPT P10636 3/20 0.43
HTT P42858 3/20 0.43
KMT2A Q03164 2/20 0.43
S1PR4 O95977 2/20 0.43
S1PR1 P21453 2/20 0.43
PAX8 Q06710 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CCR1 P32246 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
GRM5 P41594 1/20 0.42
MITF O75030 1/20 0.42

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
SCHEMBL8012346 0.80 HSD11B1 (0.43) LMNAALDH1A1L3MBTL1CCR1NPSR1
SCHEMBL8011596 0.79 SMN1; SMN2 (0.45) RAB9ASMN1; SMN2NPC1LMNAGRM1
SCHEMBL4681264 0.79 L3MBTL1 (0.51) RAB9ASMN1; SMN2NPC1NPBWR1MCHR1
SCHEMBL4678369 0.76 NPC1 (0.39) RAB9ASMN1; SMN2NPC1NPBWR1MCHR1
SCHEMBL7600596 0.75 GAA (0.37) RAB9ANPC1KMT2APAX8L3MBTL1
SCHEMBL7017303 0.74 NPC1 (0.37) RAB9ASMN1; SMN2NPC1LMNANPBWR1
SCHEMBL4678854 0.74 HTT (0.46) RAB9ASMN1; SMN2NPC1NPBWR1MCHR1
SCHEMBL7092396 0.74 NPC1 (0.37) RAB9ASMN1; SMN2NPC1LMNANPBWR1
SCHEMBL7093369 0.73 NPC1 (0.37) RAB9ASMN1; SMN2NPC1LMNANPBWR1
SCHEMBL4679289 0.73 TRPC1 (0.39) RAB9ANPC1LMNANPBWR1MCHR1

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-1262536-C Production of pyridazine herbicides SUMITOMO CHEMICAL CO (JP) 2006-07-05 CN disclosed
EP-0934254-B1 PRODUCTION OF PYRIDAZINE HERBICIDES SUMITOMO CHEMICAL CO (JP) 2002-04-17 EP disclosed
US-6333413-B1 PYRIDAZIN-3-ONE DERIVATIVES BY CYCLIZING THE CARBOXY-SUBSTITUTED HYDRAZONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-12-25 US disclosed
US-6156891-A Production of pyridazine herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-05 US disclosed
US-6093818-A Substituted pyridazin-3-one compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-07-25 US disclosed
CN-1241175-A Production of pyridazine herbicides SUMITOMO CHEMICAL CO (JP) 2000-01-12 CN disclosed
EP-0943610-A1 Substituted Pyridazin-3-one compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-22 EP disclosed
EP-0934254-A1 PRODUCTION OF PYRIDAZINE HERBICIDES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-11 EP disclosed
WO-1998017632-A1 PRODUCTION OF PYRIDAZINE HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-04-30 WO disclosed