SCHEMBL7616263

SCHEMBL7616263

C=CC(C)CCCC=CCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
F7 P08709 3/20 0.34
CYP19A1 P11511 3/20 0.34
F3 P13726 3/20 0.34
PTGS1 P23219 2/20 0.34
PPARG P37231 2/20 0.34
KMT2A Q03164 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
OXER1 Q8TDS5 2/20 0.34
ADORA3 P0DMS8 2/20 0.34
RXRA P19793 1/20 0.34
MAPT P10636 2/20 0.32
NR1I2 O75469 2/20 0.32
PTGS2 P35354 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
FFAR1 O14842 1/20 0.32
LMNA P02545 1/20 0.32
PLA2G1B P04054 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
SCHEMBL687188 0.87 TSHR (0.42) ALDH1A1F7F3PTGS1PPARG
SCHEMBL835461 0.86 ALDH1A1 (0.30) ALDH1A1CYP19A1PPARGOXER1RXRA
SCHEMBL164090 0.85 FAAH (0.43) PTGS1PPARGKMT2AMAPTMEN1
SCHEMBL10707840 0.81 TRPV1 (0.32)
SCHEMBL8936253 0.80
SCHEMBL6945419 0.80
SCHEMBL9244355 0.79 FAAH (0.47) PTGS1PPARGKMT2AMAPTMEN1
SCHEMBL10799824 0.79 PTGS1 (0.37) PTGS1PPARGKMT2AMEN1CYP3A4
SCHEMBL1535145 0.78 TSHR (0.42) ALDH1A1F7F3PTGS1PPARG
SCHEMBL11123353 0.78 PTGS1 (0.33) PTGS1PPARGKMT2AMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0766754-B1 METHOD AND APPARATUS FOR INCREASING THE FLOW RATE OF A LIQUID THROUGH AN ORIFICE KIMBERLY CLARK CO (US) 2002-09-04 EP disclosed