SCHEMBL8620110

SCHEMBL8620110

CCCC/C=C(\C)C(=O)O.COc1cccc(CC(=O)c2ccccc2)c1OC

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
NPC1 O15118 2/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HIF1A Q16665 1/20 0.41
ATM Q13315 1/20 0.40
PPARA Q07869 1/20 0.40
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
Alcohol SCHEMBL28271101 0.83 L3MBTL1 (0.53) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL265603 0.82 L3MBTL1 (0.56) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL28148825 0.81 PPARA (0.44) KMT2AMEN1NPC1RAB9AL3MBTL1
Formic Acid SCHEMBL29290938 0.80 KMT2A (0.51) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL10078464 0.79 KMT2A (0.48) KMT2AMEN1NPC1RAB9AL3MBTL1
Benzophenone SCHEMBL28093024 0.79 L3MBTL1 (0.56) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL28881926 0.76 THRA (0.47) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL8004977 0.75 KMT2A (0.46) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL18039270 0.73 KMT2A (0.46) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL8004983 0.73 KMT2A (0.44) KMT2AMEN1NPC1RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5945280-A DETECTING RESONANCE FREQUENCIES OF PIEZOELECTRIC CRYSTAL WITH POLYNUCLEOTIDE ATTATCHED TO SURFACE BEFORE AND AFTER HYBRIDIZATION OCCURS THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1999-08-31 US disclosed
US-5595908-A DETECTORS FOR POLYNUCLEOTIDES USING RESONANCE FREQUENCY UNIVERSITY OF SOUTHERN MISSISSIPI (US) 1997-01-21 US disclosed
EP-0239613-B1 PIEZOELECTRIC DEVICE FOR DETECTION OF POLYNUCLEOTIDE HYBRIDIZATION The University of Southern Mississippi (US) 1990-08-16 EP disclosed