SCHEMBL7750604

SCHEMBL7750604

CCCCc1cccc(OCO)c1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.60
PPARG P37231 4/20 0.60
CYP2D6 P10635 5/20 0.51
CYP4F2 P78329 1/20 0.50
CYP4A11 Q02928 1/20 0.50
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
KCNH2 Q12809 2/20 0.47
LPL P06858 1/20 0.46
LIPG Q9Y5X9 1/20 0.46

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
SCHEMBL516144 0.87 PPARA (0.57) PPARAPPARGCYP2D6CYP4F2CYP4A11
SCHEMBL4568880 0.87 PPARA (0.57) PPARAPPARGCYP2D6CYP4F2CYP4A11
SCHEMBL8986274 0.86 PPARA (0.59) PPARAPPARGCYP2D6KCNH2
SCHEMBL4568872 0.85 PPARA (0.56) PPARAPPARGCYP2D6CYP4F2CYP4A11
SCHEMBL4568871 0.84 PPARA (0.61) PPARAPPARGCYP2D6CNR1CNR2
SCHEMBL4568893 0.84 PPARA (0.58) PPARAPPARGCYP2D6CNR1CNR2
SCHEMBL15016678 0.82 PPARA (0.59) PPARAPPARGCYP2D6CYP4F2CYP4A11
SCHEMBL6002995 0.82 KDM4E (0.53) PPARAPPARGCYP4F2CYP4A11
SCHEMBL19365893 0.82 TSHR (0.60) PPARAPPARGCYP2D6CYP4F2CYP4A11
SCHEMBL1445872 0.81 PPARA (0.55) PPARAPPARGCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001030412-A1 FLAVOR PROTECTANT CLOSURE LINER COMPOSITIONS ZAPATA TECHNOLOGIES INC. (US) 2001-05-03 WO disclosed
US-4698286-A PRINTED CIRCUITS HERCULES INCORPORATED (US) 1987-10-06 US disclosed
US-4033773-A Radiation produced colored photopolymer systems HORIZONS INCORPORATED, A DIVISION OF HORIZONS RESEARCH INCORPORATED (US) 1977-07-05 US disclosed
US-3954468-A Radiation process for producing colored photopolymer systems HORIZONS INCORPORATED (US) 1976-05-04 US disclosed