SCHEMBL7466628

SCHEMBL7466628

CC(C)Oc1ccc(CCl)c(Cl)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.42
RORC P51449 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
KMO O15229 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SLC2A1 P11166 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
GAA P10253 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
P2RX3 P56373 1/20 0.30

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
SCHEMBL7466768 0.83 CSNK2A1 (0.53) CSNK2A1RORCMEN1KMT2ALMNA
SCHEMBL4522853 0.76 CSNK2A1 (0.45) CSNK2A1MEN1KMT2ALMNAHTR2A
SCHEMBL7468868 0.75 CSNK2A1 (0.36) CSNK2A1RORCMEN1KMT2ALMNA
SCHEMBL9016045 0.73 KMT2A (0.34) KMT2AALDH1A1TSHR
SCHEMBL3155854 0.72 SLC6A2 (0.43) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL4331816 0.72 CSNK2A1 (0.49) CSNK2A1MEN1KMT2ALMNAKDM4E
SCHEMBL20818373 0.70 CSNK2A1 (0.40) CSNK2A1HTR2AHTR2CP2RX3
SCHEMBL19612269 0.70 MCHR1 (0.44) CSNK2A1RORCMEN1KMT2AS1PR1
SCHEMBL7463498 0.69 PPOX (0.38) CSNK2A1MEN1KMT2ALMNAKDM4E
SCHEMBL10088641 0.68 CSNK2A1 (0.72) CSNK2A1RORCMEN1KMT2ALMNA

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
EP-0891336-B1 SUBSTITUTED 1-METHYL-3-BENZYLURACILS BASF AG (DE) 2002-06-05 EP disclosed
EP-0891336-A1 SUBSTITUTED 1-METHYL-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1999-01-20 EP disclosed
WO-1997035845-A1 SUBSTITUTED 1-METHYL-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1997-10-02 WO disclosed