SCHEMBL7537993

SCHEMBL7537993

[CH2]C(C)(C)CC(C)CCCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.42
OPRM1 P35372 1/20 0.39
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 1/20 0.37
DNM1 Q05193 2/20 0.36
ADH1B P00325 1/20 0.35
ADH1C P00326 1/20 0.35
ADH1A P07327 1/20 0.35
ADH4 P08319 1/20 0.35
ADH7 P40394 1/20 0.35
CA2 P00918 1/20 0.35
TSHR P16473 1/20 0.35
THRB P10828 1/20 0.35
SMPD1 P17405 3/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCI P41743 1/20 0.34

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
SCHEMBL28862050 1.00 ACE2 (0.42) ACE2OPRM1SPHK1LMNADNM1
SCHEMBL1973742 0.98 OPRM1 (0.41) ACE2OPRM1SPHK1LMNADNM1
SCHEMBL1974644 0.91 DNM1 (0.33) ACE2OPRM1DNM1CA2
SCHEMBL20483814 0.84 LMNA (0.50) LMNA
SCHEMBL17255676 0.83 ACE2 (0.40) ACE2OPRM1SPHK1LMNADNM1
SCHEMBL1005189 0.82 ACE2 (0.45) ACE2OPRM1SPHK1LMNADNM1
SCHEMBL28299272 0.82 ACE2 (0.45) ACE2OPRM1SPHK1LMNADNM1
SCHEMBL2490684 0.82 ACE2 (0.45) ACE2OPRM1SPHK1LMNADNM1
SCHEMBL1970099 0.81 TSHR (0.42) TSHR
SCHEMBL7067186 0.79 OPRM1 (0.44) ACE2OPRM1SPHK1LMNADNM1

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-0815187-B1 LUBRICANT AND FUEL COMPOSITIONS CONTAINING AN ORGANO-SUBSTITUTED DIPHENYL SULFIDE EXXONMOBIL OIL CORP (US) 2002-05-29 EP disclosed
US-5955404-A MIXTURE CONTAINING ALKYLATED DIPHENYL SULFIDE, POLYOLEFIN ENDCAPPED WITH A SUCCINIC IMIDE, AMIDE AND/OR ESTER, AND A ORGANODITHIOPHOSPHATE; WEAR RESISTANCE, EXTREME PRESSURE LUBRICANTS MOBIL OIL CORPORATION (US) 1999-09-21 US disclosed