Sugi Predict

Sugi Predict / Compounds / SCHEMBL5197214

SCHEMBL5197214

SCHEMBL5197214

ClCC1(CCl)CC1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 19/20 0.47
▸ MAOB P27338 19/20 0.47
▸ KDM1A O60341 18/20 0.47

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
SCHEMBL5740392 0.79 KDM1A (0.36) MAOAMAOBKDM1A
SCHEMBL6151983 0.78 KDM1A (0.50) MAOAMAOBKDM1A
SCHEMBL5616737 0.72 CYP2C9 (0.41) MAOAKDM1A
SCHEMBL13742046 0.72 KDM1A (0.58) MAOAMAOBKDM1A
SCHEMBL1274251 0.72 KDM1A (0.54) MAOAMAOBKDM1A
SCHEMBL1854233 0.67 KDM1A (0.54) MAOAMAOBKDM1A
SCHEMBL12946117 0.67 KDM1A (0.67) MAOAMAOBKDM1A
SCHEMBL1415636 0.67 KDM1A (0.54) MAOAMAOBKDM1A
SCHEMBL4331068 0.67 KDM1A (0.67) MAOAMAOBKDM1A
Ammonia Solution, Strong SCHEMBL11017865 0.65 KDM1A (0.64) MAOAMAOBKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836200-A1 BENZISOTHIAZOLE-1, 1-DIOXIDE ACTING AS ANTAGONISTS TO THE VANILLOID RECEPTOR SUBTYPE 1 (VR1) AND USES THEREOF ABBOTT LABORATORIES (US) 2007-09-26 — — EP disclosed
WO-2006065646-A1 BENZISOTHIAZOLE-1, 1-DIOXIDE ACTING AS ANTAGONISTS TO THE VANILLOID RECEPTOR SUBTYPE 1 (VR1) AND USES THEREOF ABBOTT LABORATORIES (US) 2006-06-22 — — WO disclosed