SCHEMBL5695278

SCHEMBL5695278

CC(C)CCCCCCCCCCCOCCCN

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
LMNA P02545 1/20 0.39
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
ODC1 P11926 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
TRPA1 O75762 1/20 0.34
HTT P42858 2/20 0.34
TLR2 O60603 5/20 0.33
SPHK2 Q9NRA0 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
MEN1 O00255 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
RARB P10826 1/20 0.31
CPB2 Q96IY4 1/20 0.31

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
SCHEMBL26445 1.00 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL8391126 1.00 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL496717 1.00 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL495770 1.00 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL587402 1.00 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL23270388 1.00 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL20090501 0.98 CYP3A4 (0.42) CYP3A4LMNAHTR1AHTR1DHTR1B
Ethylene SCHEMBL15689753 0.96 CYP3A4 (0.39) CYP3A4LMNAHTR1AHTR1DHTR1B
Ethylene SCHEMBL14485776 0.96 CYP3A4 (0.39) CYP3A4LMNAHTR1AHTR1DHTR1B
SCHEMBL22525986 0.95 CYP3A4 (0.41) CYP3A4LMNAHTR1AHTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228172-B1 SUBSTITUTED LINEAR THIOUREA COMPOUNDS AS ADDITIVES FOR LUBRICANTS CHEMTURA CORP (US) 2006-05-31 EP claimed
EP-1228172-A1 SUBSTITUTED LINEAR THIOUREA COMPOUNDS AS ADDITIVES FOR LUBRICANTS Crompton Corporation (US) 2002-08-07 EP claimed
WO-2001036572-A1 SUBSTITUTED LINEAR THIOUREA COMPOUNDS AS ADDITIVES FOR LUBRICANTS CROMPTON CORPORATION (US) 2001-05-25 WO claimed
US-6187726-B1 ALKYL ETHER OR SULFIDE SIDE CHAIN THAT ENABLES THE ADDITIVE TO BE SOLUBLE IN FULLY FORMULATED CRANKCASE OIL BASED ON MINERAL AND GROUP II, III, AND IV BASE OILS CK WITCO CORPORATION 2001-02-13 US claimed
EP-1228172-B1 SUBSTITUTED LINEAR THIOUREA COMPOUNDS AS ADDITIVES FOR LUBRICANTS CHEMTURA CORP (US) 2006-05-31 EP disclosed
EP-1228172-A1 SUBSTITUTED LINEAR THIOUREA COMPOUNDS AS ADDITIVES FOR LUBRICANTS Crompton Corporation (US) 2002-08-07 EP disclosed
WO-2001036572-A1 SUBSTITUTED LINEAR THIOUREA COMPOUNDS AS ADDITIVES FOR LUBRICANTS CROMPTON CORPORATION (US) 2001-05-25 WO disclosed
US-6187726-B1 ALKYL ETHER OR SULFIDE SIDE CHAIN THAT ENABLES THE ADDITIVE TO BE SOLUBLE IN FULLY FORMULATED CRANKCASE OIL BASED ON MINERAL AND GROUP II, III, AND IV BASE OILS CK WITCO CORPORATION 2001-02-13 US disclosed