SCHEMBL9840734

SCHEMBL9840734

CC(OC(=O)/C=C\C(=O)OC(C)Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.53
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
GAA P10253 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
PKM P14618 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL9860972 1.00 HCAR2 (0.53) HCAR2MTNR1AMTNR1BGAACYP1A2
SCHEMBL9860987 1.00 HCAR2 (0.53) HCAR2MTNR1AMTNR1BGAACYP1A2
SCHEMBL9840743 0.95 HCAR2 (0.61) HCAR2MTNR1AMTNR1BGAACYP1A2
SCHEMBL8897595 0.87 MTNR1A (0.42) HCAR2MTNR1AMTNR1BGAACYP1A2
SCHEMBL12100901 0.87 HCAR2 (0.42) HCAR2MTNR1AMTNR1BGAACYP1A2
SCHEMBL34034 0.86 THRB (0.46) HCAR2MTNR1AMTNR1BGAACYP1A2
Water SCHEMBL28126876 0.84 THRB (0.45) HCAR2MTNR1AMTNR1BGAACYP1A2
Benzaldehyde SCHEMBL10616964 0.83 KMT2A (0.44) HCAR2MTNR1AMTNR1BGAACYP1A2
SCHEMBL8895270 0.83 MTNR1A (0.43) HCAR2MTNR1AMTNR1BGAACYP1A2
Acrylic Acid SCHEMBL7185233 0.83 THRB (0.44) HCAR2MTNR1AMTNR1BGAACYP1A2

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
US-4990428-A Photopolymerizable compound overcoating aluminum(or alloy therof), and aluminum oxide layers MITSUBISHI KASEI CORPORATION (JP) 1991-02-05 US disclosed
EP-0179448-B1 PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE MITSUBISHI KASEI CORPORATION (JP) 1990-04-18 EP disclosed
EP-0179448-A2 Photosensitive planographic printing plate MITSUBISHI KASEI CORPORATION (JP) 1986-04-30 EP disclosed