SCHEMBL4685945

SCHEMBL4685945

Cc1ccc(C(=O)NC(NC(=S)Nc2ccccc2C)C(F)(F)F)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.63
L3MBTL1 Q9Y468 2/20 0.63
NPC1 O15118 1/20 0.63
RAB9A P51151 1/20 0.63
ALDH1A1 P00352 9/20 0.59
LMNA P02545 8/20 0.59
KMT2A Q03164 7/20 0.59
MAPT P10636 7/20 0.59
MEN1 O00255 6/20 0.59
ALOX12 P18054 5/20 0.59
HTT P42858 3/20 0.53
EPHX1 P07099 2/20 0.52
KDM4E B2RXH2 2/20 0.49
GAA P10253 1/20 0.47
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL4680564 0.89 ALDH1A1 (0.53) NPSR1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL5212904 0.86 ALDH1A1 (0.56) NPSR1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL4682172 0.85 MAPT (0.56) NPSR1NPC1RAB9AALDH1A1LMNA
SCHEMBL4682138 0.85 ALDH1A1 (0.48) NPSR1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL4684022 0.84 KMT2A (0.63) NPSR1NPC1RAB9AALDH1A1LMNA
SCHEMBL4682145 0.83 ALDH1A1 (0.57) NPSR1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL4679775 0.81 LMNA (0.53) NPSR1ALDH1A1LMNAKMT2AMAPT
SCHEMBL6672512 0.81 LMNA (0.53) NPSR1ALDH1A1LMNAKMT2AMAPT
SCHEMBL4683495 0.81 MAPT (0.51) NPSR1L3MBTL1NPC1RAB9AALDH1A1
SCHEMBL4682188 0.81 ALDH1A1 (0.48) NPSR1L3MBTL1NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1198456-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2007-09-19 EP claimed
EP-1392655-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2004-03-03 EP claimed
JP-2003506355-A 2003-02-18 JP claimed
WO-2002062762-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO claimed
EP-1198456-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-24 EP claimed
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 US claimed
WO-2001009096-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2001-02-08 WO claimed
EP-1392655-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2008-07-16 EP disclosed
EP-1198456-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2007-09-19 EP disclosed
EP-1392655-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2004-03-03 EP disclosed
US-6645968-B2 E.g., N-(1-((anilinocarbonyl)amino)-2,2,2-trichloroethyl)-4-methyl-benzamide; antiepileptic, -ischemic and cardiotonic agents; sexual, eating and urogenital disorders; asthma; migraines; ABBOTT LABORATORIES 2003-11-11 US disclosed
WO-2002062762-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO disclosed
EP-1198456-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-24 EP disclosed
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 US disclosed
WO-2001009096-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2001-02-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020028836-A1 Potassium channel openers KCNJ2, KCNJ11, KCNJ1 NPSR1 2087/4885L3MBTL1 869/4885NPC1 220/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.