SCHEMBL6898869

SCHEMBL6898869

NOC(=O)CCCCCc1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.49
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
CDYL Q9Y232 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
MCL1 Q07820 2/20 0.44
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
SLC16A3 O15427 1/20 0.42
FFAR1 O14842 1/20 0.42
AKR1B1 P15121 1/20 0.42

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
SCHEMBL28789110 0.85 CYP1A2 (0.52) MTNR1ACYP4F2CYP4A11CDYLTDP1
SCHEMBL11414169 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL29865501 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL29865603 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL3732554 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL6842066 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL1616841 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL710750 0.81 TDP1 (0.59) MTNR1ATDP1MCL1CYP1A2SLC16A3
SCHEMBL6682789 0.81 FOLH1 (0.53) MTNR1A
SCHEMBL6472349 0.80 TDP1 (0.57) MTNR1ATDP1MCL1CYP1A2SLC16A3

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
JP-2004318111-A COLORED PHOTOSENSITIVE RESIN COMPOSITION SUMITOMO CHEM CO LTD 2004-11-11 JP disclosed