SCHEMBL7927083

SCHEMBL7927083

CCCCCCCCOc1cccc(OCCCCCCCC)c1[NH]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NR1I2 O75469 1/20 0.51
LMNA P02545 1/20 0.51
CHRM2 P08172 1/20 0.51
CYP3A4 P08684 1/20 0.51
ADRA2A P08913 1/20 0.51
MAPT P10636 1/20 0.51
OPRK1 P41145 1/20 0.51
HTR2B P41595 1/20 0.51
SLC6A3 Q01959 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
MCHR1 Q99705 3/20 0.51
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 1/20 0.47
NR5A1 Q13285 1/20 0.44
TLR8 Q9NR97 2/20 0.44
LTA4H P09960 1/20 0.43

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
SCHEMBL7933096 1.00 MEN1 (0.51) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL7921351 0.92 CYP1A2 (0.57) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL7928274 0.85 MCHR1 (0.47) MEN1KMT2ALMNACHRM2MAPT
SCHEMBL9394792 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL1964196 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL2859001 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL29868324 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL2245919 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL1778134 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL9387360 0.83 LMNA (0.62) MEN1KMT2ANR1I2LMNACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed