SCHEMBL8464166

SCHEMBL8464166

CC(C)=CCCC(C)=C(C)C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.50
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 2/20 0.50
MAPT P10636 2/20 0.48
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
UGT1A1 P22309 1/20 0.48
SQLE Q14534 5/20 0.46
KDM4E B2RXH2 2/20 0.44
ATM Q13315 1/20 0.44
POLB P06746 1/20 0.43
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
PGR P06401 1/20 0.40

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
SCHEMBL7047402 0.90 KMT2A (0.73) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL29056157 0.82 KMT2A (0.68) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL2516095 0.78 KMT2A (0.50) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL2522774 0.78 KMT2A (0.52) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL26691679 0.78 KMT2A (0.52) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL19454910 0.76 KMT2A (0.48) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL8388835 0.75
SCHEMBL8600826 0.74 ALDH1A1 (0.50) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL6895251 0.74 KMT2A (0.48) KMT2AMEN1CYP3A4ALOX15MAPT
SCHEMBL8600822 0.74 ALDH1A1 (0.50) KMT2AMEN1CYP3A4ALOX15MAPT

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
US-5859277-A Silicon-containing solid support linker WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-01-12 US disclosed