SCHEMBL6746593

SCHEMBL6746593

CCCCC1COC(C2CCC(C3CCC(OC(=O)C(F)(F)F)CC3)CC2)OC1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.37
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL6750506 0.87 NAAA (0.46) NAAAPOLBHPGDCYP1A2MAPT
SCHEMBL6746660 0.87 NAAA (0.46) NAAAPOLBHPGDCYP1A2MAPT
SCHEMBL10657472 0.81 NAAA (0.44) NAAAPOLBHPGDCYP1A2MAPT
SCHEMBL10657479 0.81 NAAA (0.44) NAAAPOLBHPGDCYP1A2MAPT
SCHEMBL23635423 0.81 NAAA (0.34) NAAA
SCHEMBL6746586 0.79 TLR4 (0.38) NAAAMAPT
SCHEMBL19854483 0.76 NAAA (0.45) NAAA
SCHEMBL6750436 0.75 CYP1A2 (0.38) POLBHPGDCYP1A2MAPT
SCHEMBL9315738 0.75 CYP1A2 (0.37) POLBHPGDCYP1A2MAPT
SCHEMBL9315734 0.75 CYP1A2 (0.37) POLBHPGDCYP1A2MAPT

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-6685995-B1 LOW VOLTAGE, WIDE TEMPERATURE RANGE DRIVING; HIGH SPEED RESPONSE CHISSO CORPORATION (JP) 2004-02-03 US disclosed
EP-1053996-A1 ESTER COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 2000-11-22 EP disclosed