SCHEMBL8384530

SCHEMBL8384530

CCCCCCCCCCCCOc1ccccc1-c1ccccc1I

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
NR1I2 O75469 1/20 0.49
LMNA P02545 1/20 0.49
CHRM2 P08172 1/20 0.49
CYP3A4 P08684 1/20 0.49
ADRA2A P08913 1/20 0.49
MAPT P10636 1/20 0.49
OPRK1 P41145 1/20 0.49
HTR2B P41595 1/20 0.49
SLC6A3 Q01959 1/20 0.49
KMT2A Q03164 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
PDE5A O76074 4/20 0.48
PDE4A P27815 3/20 0.48
PDE4B Q07343 3/20 0.48
PDE4C Q08493 3/20 0.48
PDE4D Q08499 3/20 0.48
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47

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
SCHEMBL2038149 1.00 MEN1 (0.49) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL8382149 1.00 MEN1 (0.49) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL1598554 0.93 CYP1A2 (0.53) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL16582005 0.89 MEN1 (0.57) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL5930195 0.86 LMNA (0.54) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL4660995 0.86 LMNA (0.54) MEN1NR1I2LMNACHRM2CYP3A4
Trifluoromethanesulfonic Acid SCHEMBL8736420 0.85 PTGDR2 (0.45) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9598552 0.84 CYP1A2 (0.53) MEN1NR1I2LMNACHRM2CYP3A4
Perflubutane SCHEMBL3873217 0.83 PTGDR2 (0.43) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9347920 0.83 S1PR3 (0.47) MEN1NR1I2LMNACHRM2CYP3A4

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-6008265-A CATIONIC POLYMERS HAVING ONIUM GROUPS AND A SULFONIMIDE ANION AS PHOTOINITIATORS FOR PHOTOPOLYMERIZATION; ADHESIVES; COATINGS; PHOTORESISTS HYDRO-QUEBEC (CA) 1999-12-28 US disclosed