SCHEMBL28322907

SCHEMBL28322907

C=C(CCOc1ccccc1)C(=O)OC.[CH2]CC(C)(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.45
MAPT P10636 4/20 0.45
NPC1 O15118 4/20 0.45
KMT2A Q03164 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
MEN1 O00255 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP2D6 P10635 1/20 0.45
HDAC3 O15379 3/20 0.44
HDAC4 P56524 3/20 0.44
HDAC1 Q13547 3/20 0.44
HDAC7 Q8WUI4 3/20 0.44
HDAC2 Q92769 3/20 0.44
HDAC10 Q969S8 3/20 0.44
HDAC11 Q96DB2 3/20 0.44
HDAC8 Q9BY41 3/20 0.44

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
SCHEMBL28058450 0.90 RAB9A (0.53) RAB9AMAPTNPC1KMT2ACYP1A2
Acrylic Acid SCHEMBL27995648 0.83 THRB (0.50) RAB9AMAPTNPC1KMT2ACYP1A2
SCHEMBL28009381 0.83 HPGD (0.55) RAB9AMAPTNPC1KMT2ACYP1A2
SCHEMBL21225985 0.83 KDM4E (0.57) RAB9AMAPTNPC1KMT2AMEN1
SCHEMBL28229682 0.80 MTNR1A (0.44) RAB9AMAPTNPC1KMT2ACYP1A2
SCHEMBL28225095 0.78 POLB (0.48) RAB9AMAPTNPC1KMT2ACYP1A2
SCHEMBL28302909 0.77 TSHR (0.48) RAB9AMAPTNPC1KMT2ACYP1A2
SCHEMBL15940425 0.76 CYP1A2 (0.50) RAB9ANPC1KMT2ACYP1A2CYP3A4
SCHEMBL7410091 0.76 MAPT (0.49) RAB9AMAPTNPC1KMT2AMEN1
SCHEMBL11294405 0.76 TDP1 (0.54) RAB9AMAPTNPC1KMT2ACYP1A2

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
CN-110320747-A CURABLE RESIN COMPOSITION, DRY FILM, CURED PRODUCT, AND PRINTED WIRING BOARD 太阳油墨制造株式会社 2019-10-11 CN disclosed