SCHEMBL4411899

SCHEMBL4411899

C=CCC(CCC(=C)C(=O)O)Oc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 4/20 0.37
KDM4E B2RXH2 3/20 0.37
MEN1 O00255 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PPARG P37231 4/20 0.35
PPARA Q07869 4/20 0.35
THRB P10828 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
FFAR1 O14842 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALPL P05186 1/20 0.32

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
SCHEMBL10903531 0.87 CYP2C19 (0.42) CYP2C19KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL2108376 0.79 CYP2C19 (0.39) CYP2C19KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL2063527 0.79 ALDH1A1 (0.39) CYP2C19PPARGPPARAMTNR1AMTNR1B
SCHEMBL1778182 0.78 CYP2C19 (0.41) CYP2C19KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL11115583 0.77 CYP2C19 (0.45) CYP2C19KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL8961806 0.77 CYP2C19 (0.36) CYP2C19KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL446021 0.76 MTNR1A (0.50) CYP2C19KMT2AMEN1MTNR1AMTNR1B
SCHEMBL2346336 0.76 PPARA (0.41) KMT2AMEN1PPARGPPARAMTNR1A
SCHEMBL1811046 0.75 CYP2C19 (0.41) CYP2C19KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL2843955 0.75 SLC6A4 (0.50) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215963-A1 Thermoplastic elastomeric material and process for its manufacturing PIRELLI & C. S.P.A., (IT) 2009-08-27 US claimed
EP-1778753-B1 THERMOPLASTIC ELASTOMERIC MATERIAL AND PROCESS FOR ITS MANUFACTURING PIRELLI & C SPA (IT) 2008-11-19 EP claimed
US-20090215963-A1 Thermoplastic elastomeric material and process for its manufacturing PIRELLI & C. S.P.A., (IT) 2009-08-27 US disclosed
US-6476108-B1 Aqueous coating composition JSR CORPORATION (JP) 2002-11-05 US disclosed
EP-1253173-A2 Aqueous coating composition and floor polishing composition JSR Corporation (JP) 2002-10-30 EP disclosed