SCHEMBL2955715

SCHEMBL2955715

CCCCCCCCCCCCC(N)CC(CC)CCCC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
PLA2G1B P04054 1/20 0.47
PLA2G2A P14555 1/20 0.47
LMNA P02545 1/20 0.45
CYP3A4 P08684 2/20 0.43
TSHR P16473 1/20 0.43
S1PR2 O95136 5/20 0.43
S1PR1 P21453 5/20 0.43
S1PR3 Q99500 5/20 0.43
S1PR4 O95977 4/20 0.43
OPRM1 P35372 1/20 0.43
SPHK1 Q9NYA1 2/20 0.41
DNM1 Q05193 1/20 0.39

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
SCHEMBL27960459 1.00 ALDH1A1 (0.50) ALDH1A1TDP1PLA2G1BPLA2G2ALMNA
SCHEMBL11663396 1.00 ALDH1A1 (0.50) ALDH1A1TDP1PLA2G1BPLA2G2ALMNA
SCHEMBL27519252 0.90 ALDH1A1 (0.50) ALDH1A1TDP1CYP3A4TSHRDNM1
SCHEMBL11663281 0.87 ALDH1A1 (0.54) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL2831622 0.87 ALDH1A1 (0.58) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL25682552 0.87 ALDH1A1 (0.52) ALDH1A1TDP1PLA2G1BPLA2G2ACYP3A4
SCHEMBL25125699 0.85 OPRM1 (0.54) ALDH1A1TDP1PLA2G1BPLA2G2ALMNA
SCHEMBL10824797 0.85 ALDH1A1 (0.56) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL19261752 0.85 PLA2G1B (0.52) ALDH1A1TDP1PLA2G1BPLA2G2ALMNA
SCHEMBL758110 0.84 ALDH1A1 (0.54) ALDH1A1TDP1LMNACYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1874900-A2 MOLYBDENUM DIALKYLDITHIOCARBAMATE COMPOSITIONS AND LUBRICATING COMPOSITIONS CONTAINING THE SAME R.T. VANDERBILT COMPANY, INC. (US) 2008-01-09 EP claimed
WO-2006094011-A2 MOLYBDENUM DIALKYLDITHIOCARBAMATE COMPOSITIONS AND LUBRICATING COMPOSITIONS CONTAINING THE SAME R.T. VANDERBILT COMPANY, INC. (US) 2006-09-08 WO claimed
US-20060199745-A1 Molybdenum dialkyldithiocarbamate compositions and lubricating compositions containing the same R.T. VANDERBILT COMPANY, INC. (US) 2006-09-07 US claimed
US-7763744-B2 Molybdenum dialkyldithiocarbamate compositions and lubricating compositions containing the same R.T. VANDERBILT COMPANY, INC. (US) 2010-07-27 US disclosed
EP-1874900-A2 MOLYBDENUM DIALKYLDITHIOCARBAMATE COMPOSITIONS AND LUBRICATING COMPOSITIONS CONTAINING THE SAME R.T. VANDERBILT COMPANY, INC. (US) 2008-01-09 EP disclosed
WO-2006094011-A2 MOLYBDENUM DIALKYLDITHIOCARBAMATE COMPOSITIONS AND LUBRICATING COMPOSITIONS CONTAINING THE SAME R.T. VANDERBILT COMPANY, INC. (US) 2006-09-08 WO disclosed
US-20060199745-A1 Molybdenum dialkyldithiocarbamate compositions and lubricating compositions containing the same R.T. VANDERBILT COMPANY, INC. (US) 2006-09-07 US disclosed