SCHEMBL5166147

SCHEMBL5166147

C=C(CN(C)Cc1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1O[SiH](C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
KCNH2 Q12809 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
NR1I2 O75469 1/20 0.35
ADRA2A P08913 1/20 0.35
CYP2D6 P10635 1/20 0.35
ACHE P22303 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
NR1H4 Q96RI1 2/20 0.33
HIF1A Q16665 2/20 0.32
TMEM97 Q5BJF2 1/20 0.32
ESRRB O95718 1/20 0.32
ESRRG P62508 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
MEN1 O00255 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL5169309 0.77 MAPT (0.46) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL5683031 0.77 SQLE (0.36) LMNASIGMAR1ADRA2ACYP2D6SLC6A2
SCHEMBL5683050 0.77 SQLE (0.36) LMNASIGMAR1ADRA2ACYP2D6SLC6A2
SCHEMBL5168558 0.76 NR1H4 (0.38) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL5165653 0.76 FLT1 (0.43) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL25265218 0.75 TDP1 (0.36) LMNANR1H4MEN1KMT2ACYP2C19
SCHEMBL5166710 0.74 SIGMAR1 (0.45) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL5165584 0.73 SIGMAR1 (0.45) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL5167008 0.72 SIGMAR1 (0.44) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL5167060 0.72 SIGMAR1 (0.44) LMNAKCNH2SIGMAR1NR1I2ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1561744-B1 AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS ANTIMYCOTIC AGENT POLA CHEM IND INC (JP) 2007-04-18 EP claimed
EP-1561744-A2 AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS ANTIMYCOTIC AGENT POLA CHEMICAL INDUSTRIES INC. (JP) 2005-08-10 EP claimed
US-6329399-B1 Antifungal amine derivatives and processing for producing the same POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 US claimed
EP-1020426-A1 AMINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-07-19 EP claimed
EP-1561744-B1 AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS ANTIMYCOTIC AGENT POLA CHEM IND INC (JP) 2007-04-18 EP disclosed
EP-1561744-A2 AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS ANTIMYCOTIC AGENT POLA CHEMICAL INDUSTRIES INC. (JP) 2005-08-10 EP disclosed
US-6329399-B1 Antifungal amine derivatives and processing for producing the same POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 US disclosed
EP-1020426-A1 AMINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-07-19 EP disclosed