SCHEMBL21795198

SCHEMBL21795198

CC(C)C1=Nc2ccc3ccccc3c2C1(C)C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
MAPT P10636 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
ALDH1A1 P00352 4/20 0.34
CYP2A6 P11509 3/20 0.34
TSHR P16473 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CCR4 P51679 1/20 0.33
CYP1A2 P05177 4/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL4415820 0.86 MEN1 (0.62) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL14452219 0.84 MEN1 (0.60) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL29499501 0.78 MEN1 (1.00) MEN1KMT2AMAPTTDP1KDM4E
Hydrochloric Acid SCHEMBL22321960 0.77 MEN1 (0.97) MEN1KMT2AMAPTTDP1KDM4E
Iodide SCHEMBL22542621 0.77 MEN1 (0.97) MEN1KMT2AMAPTTDP1KDM4E
Iodide SCHEMBL29456898 0.77 MEN1 (0.97) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL11947486 0.74 MEN1 (0.64) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL4417719 0.72 MEN1 (0.60) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL4422814 0.71 KMT2A (0.59) MEN1KMT2AMAPTTDP1KDM4E
Hydrochloric Acid SCHEMBL4422818 0.71 MEN1 (0.59) MEN1KMT2AMAPTTDP1KDM4E

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
WO-2020047477-A1 CATIONIC COMPOUNDS FOR DELIVERY OF NUCLEIC ACIDS CITY OF HOPE (US) 2020-03-05 WO disclosed