SCHEMBL10936236

SCHEMBL10936236

CCCCCCCCCCCCCCCOCC(C)C#N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.48
SPHK1 Q9NYA1 1/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 1/20 0.45
THRB P10828 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 1/20 0.45
PRKD3 O94806 1/20 0.42
PRKCG P05129 1/20 0.42
PRKCB P05771 1/20 0.42
PRKCA P17252 1/20 0.42
PRKCH P24723 1/20 0.42
PRKCI P41743 1/20 0.42
PRKCE Q02156 1/20 0.42
PRKCQ Q04759 1/20 0.42
PRKCZ Q05513 1/20 0.42
PRKCD Q05655 1/20 0.42
PRKD1 Q15139 1/20 0.42
LPAR1 Q92633 7/20 0.41
LPAR3 Q9UBY5 7/20 0.41

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
SCHEMBL11635700 1.00 USP2 (0.48) USP2SPHK1HTTMEN1THRB
SCHEMBL10937893 1.00 USP2 (0.48) USP2SPHK1HTTMEN1THRB
SCHEMBL8755573 0.92 TSHR (0.43) USP2SPHK1HTTMEN1THRB
SCHEMBL5168007 0.83
SCHEMBL10936380 0.80 TSHR (0.40)
SCHEMBL28943099 0.77 USP2 (0.46) USP2SPHK1HTTMEN1THRB
SCHEMBL10151450 0.76 USP2 (0.57) USP2SPHK1HTTMEN1THRB
SCHEMBL4489928 0.76 USP2 (0.57) USP2SPHK1HTTMEN1THRB
SCHEMBL2766746 0.76 USP2 (0.57) USP2SPHK1HTTMEN1THRB
SCHEMBL3794737 0.76 USP2 (0.57) USP2SPHK1HTTMEN1THRB

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
US-4491525-A Oil recovery with surfactant flooding PHILLIPS PETROLEUM COMPANY (US) 1985-01-01 US disclosed
US-4335787-A SURFACTANT SYSTEM COMPRISING A HYDROCARBON SULFONATE AND A NITRILE PHILLIPS PETROLEUM COMPANY (US) 1982-06-22 US disclosed