SCHEMBL8196841

SCHEMBL8196841

CCCCCCc1ccc2c(c1CCCCCC)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 8/20 0.48
MAPT P10636 4/20 0.48
HPGD P15428 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
MEN1 O00255 2/20 0.48
HTT P42858 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP2C19 P33261 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
SMAD3 P84022 1/20 0.48
PRMT1 Q99873 1/20 0.48
ACE2 Q9BYF1 1/20 0.48
ALOX15 P16050 3/20 0.47
ALOX12 P18054 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CYP2C9 P11712 1/20 0.47
BRCA1 P38398 1/20 0.47
CYP3A4 P08684 3/20 0.43

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
SCHEMBL3788322 1.00 FTO (0.48) FTOMAPTHPGDTDP1MEN1
SCHEMBL19206099 0.96 FTO (0.50) FTOMAPTHPGDTDP1MEN1
SCHEMBL3694702 0.89 FTO (0.51) FTOMAPTHPGDTDP1MEN1
SCHEMBL4941647 0.89 FTO (0.52) FTOMAPTHPGDTDP1MEN1
SCHEMBL989819 0.88 FTO (0.52) FTOMAPTHPGDTDP1MEN1
SCHEMBL6738373 0.88 FTO (0.52) FTOMAPTHPGDTDP1MEN1
SCHEMBL5687967 0.86 FTO (0.45) FTOMAPTHPGDTDP1MEN1
SCHEMBL10397269 0.85 FTO (0.46) FTOMAPTHPGDTDP1MEN1
SCHEMBL622479 0.84 FTO (0.54) FTOMAPTHPGDTDP1MEN1
SCHEMBL17079673 0.83 FTO (0.55) FTOMAPTHPGDTDP1MEN1

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
EP-0820498-B1 DEVELOPER SYSTEM FOR BASE REACTABLE PETROLEUM FUEL MARKERS UNITED COLOR MFG INC (US) 2000-06-28 EP disclosed
EP-0820498-A1 DEVELOPER SYSTEM FOR BASE REACTABLE PETROLEUM FUEL MARKERS United Color Manufacturing Inc. (US) 1998-01-28 EP disclosed
US-5672182-A QUATERNARY ALKYL AMMONIUM BASE AS DEVELOPER AND COLOR OR FLUORESCENT MARKER UNITED COLOR MANUFACTURING INC. (US) 1997-09-30 US disclosed
WO-1996032461-A1 DEVELOPER SYSTEM FOR BASE REACTABLE PETROLEUM FUEL MARKERS UNITED COLOR MANUFACTURING, INC. (US) 1996-10-17 WO disclosed