Ethane

Ethane

SCHEMBL7865865

CC.NC(=O)C(NCc1ccc(Oc2cccc(F)c2)cc1)c1ccccc1

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.52
SCN9A Q15858 2/20 0.52
MAOA P21397 1/20 0.52
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
KLKB1 P03952 1/20 0.43
ALOX5 P09917 1/20 0.43
PTGS1 P23219 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
SCHEMBL5684137 0.98 MAOB (0.51) MAOBSCN9AMAOAMEN1KMT2A
SCHEMBL5684150 0.98 MAOB (0.51) MAOBSCN9AMAOAMEN1KMT2A
Cyclopropane SCHEMBL7860821 0.94 HTR2C (0.50) MAOBSCN9AMAOAMEN1KMT2A
SCHEMBL5695724 0.88 ULK1 (0.51) KMT2AHTR2CHTR2B
SCHEMBL5684479 0.88 ULK1 (0.51) KMT2AHTR2CHTR2B
SCHEMBL5684469 0.88 ULK1 (0.51) KMT2AHTR2CHTR2B
SCHEMBL5682167 0.86 LTA4H (0.46) MAOBSCN9AMAOAKMT2A
SCHEMBL7865863 0.83 ACACB (0.46) MAOBSCN9AMAOAMEN1KMT2A
SCHEMBL5695674 0.83 ACACB (0.46) MAOBSCN9AMAOAMEN1KMT2A
SCHEMBL1070319 0.82 MAOB (0.72) MAOBSCN9AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6303819-B1 SODIUM CHANNEL-BLOCKING AGENT; CHRONIC OR NEUROPATHIC PAIN. NEWRON PHARMACEUTICALS S.P.A. (IT) 2001-10-16 US disclosed
EP-1044186-A1 SUBSTITUTED 2-BENZYLAMINO-2-PHENYL-ACETAMIDE COMPOUNDS Newron Pharmaceuticals S.p.A. (IT) 2000-10-18 EP disclosed
WO-1999035123-A1 SUBSTITUTED 2-BENZYLAMINO-2-PHENYL-ACETAMIDE COMPOUNDS NEWRON PHARMACEUTICALS S.P.A. (IT) 1999-07-15 WO disclosed