SCHEMBL8955990

SCHEMBL8955990

OCCCCCCCCOc1c(Cl)cccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 4/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTR1A P08908 2/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
PDK2 Q15119 1/20 0.38
CNR2 P34972 1/20 0.37
MEN1 O00255 1/20 0.37
PYGL P06737 1/20 0.36

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
SCHEMBL10358952 0.85 KMT2A (0.53) KMT2AL3MBTL1HPGDKDM4EALDH1A1
SCHEMBL4055640 0.80 KMT2A (0.44) KMT2AL3MBTL1HPGDKDM4EALDH1A1
SCHEMBL20414593 0.80 L3MBTL1 (0.51) KMT2AL3MBTL1HPGDKDM4EALDH1A1
SCHEMBL8778511 0.80 KMT2A (0.44) KMT2AL3MBTL1HPGDKDM4EALDH1A1
SCHEMBL11450595 0.80 KMT2A (0.44) KMT2AL3MBTL1HPGDKDM4EALDH1A1
SCHEMBL8955424 0.79 TDP1 (0.67) KMT2AL3MBTL1KDM4EALDH1A1TP53
SCHEMBL27904038 0.79 TDP1 (0.67) KMT2AL3MBTL1KDM4EALDH1A1TP53
SCHEMBL10461262 0.79 KMT2A (0.50) KMT2AL3MBTL1HPGDKDM4EALDH1A1
SCHEMBL8956162 0.78 L3MBTL1 (0.57) KMT2AL3MBTL1HPGDALDH1A1TP53
SCHEMBL8997378 0.78 KDM4E (0.45) KMT2AL3MBTL1HPGDKDM4EALDH1A1

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-5516767-A PRODRUG AS HYPOGLYCEMIC AGENT SANDOZ LTD. (CH) 1996-05-14 US disclosed
US-5412137-A Hypoglycemic agents SANDOZ LTD. (CH) 1995-05-02 US disclosed