SCHEMBL7532146

SCHEMBL7532146

CCCCCCCCCCCCCCCCCC(=O)NN1CC(C)CC(C)C1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.55
GNAO1 P09471 1/20 0.55
GNAI1 P63096 1/20 0.55
TRPV1 Q8NER1 6/20 0.49
CNR1 P21554 4/20 0.49
CNR2 P34972 4/20 0.49
EPHX2 P34913 1/20 0.46
HSP90AA1 P07900 1/20 0.46
FAAH O00519 2/20 0.44
NAAA Q02083 3/20 0.43
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 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
SCHEMBL7537718 0.82 GNAI3 (0.54) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL8588178 0.76 GNAI3 (0.71) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL11215579 0.76 GNAI3 (0.71) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL3871463 0.76 GNAI3 (0.71) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL3974367 0.75 GNAI3 (0.69) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL3868277 0.75 GNAI3 (0.69) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL16010753 0.75 GNAI3 (0.69) GNAI3GNAO1GNAI1TRPV1CNR1
SCHEMBL11698006 0.71 CNR1 (0.56) TRPV1CNR1CNR2EPHX2FAAH
SCHEMBL8587014 0.70 GNAI3 (0.49) GNAI3GNAO1GNAI1
SCHEMBL7103156 0.70 HSP90AA1 (0.70) HSP90AA1FAAHMEN1MAPK1KMT2A

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
EP-0873277-B1 USE OF AMIDES FOR CONTROLLING BIOFOULING USING AMIDES BUCKMAN LABOR INC (US) 2002-05-02 EP claimed
US-6030971-A INHIBITING BACTERIA FROM ADHERING TO A SUBMERGIBLE SURFACE WITHOUT KILLING THE BACTERIA BY TREATING WITH AN N-HETROCYCLIC AMIDE; ANTIFOULING AGENTS; BOATS; DENISTRY; WATER TREATMENT; IMPLANTS BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2000-02-29 US claimed
EP-0873277-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING AMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-10-28 EP claimed
WO-1997011910-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING AMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-04-03 WO claimed
EP-0873277-B1 USE OF AMIDES FOR CONTROLLING BIOFOULING USING AMIDES BUCKMAN LABOR INC (US) 2002-05-02 EP disclosed
US-6030971-A INHIBITING BACTERIA FROM ADHERING TO A SUBMERGIBLE SURFACE WITHOUT KILLING THE BACTERIA BY TREATING WITH AN N-HETROCYCLIC AMIDE; ANTIFOULING AGENTS; BOATS; DENISTRY; WATER TREATMENT; IMPLANTS BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2000-02-29 US disclosed
EP-0873277-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING AMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-10-28 EP disclosed
US-5814668-A AMIDE COMPOUNDS AS BACTERICIDES IN WATER BUCKMAN LABORATORIES INTERNATIONAL INC. (US) 1998-09-29 US disclosed
WO-1997011910-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING AMIDES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-04-03 WO disclosed