SCHEMBL9879377

SCHEMBL9879377

CCCc1ccccc1Nc1ccccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.47
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
HTR1A P08908 1/20 0.43
MAPT P10636 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
HIF1A Q16665 1/20 0.39
MAPK1 P28482 2/20 0.39
POLB P06746 2/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL13813554 0.88 ADRA2B (0.46) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL6106510 0.87 CXCR2 (0.58) GAACXCR2
SCHEMBL7773988 0.85 GAA (0.50) GAACA12CA2CA9MAPT
SCHEMBL18944529 0.79 MAPT (0.45) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL11019335 0.79 CA12 (0.48) GAACA12CA2CA9MAPT
SCHEMBL9082201 0.78 CXCL8 (0.56) GAAMAPTADRA2BADRA2CL3MBTL1
SCHEMBL30595395 0.78 HTR1A (0.64) CA12CA2CA9HTR1ACYP2D6
SCHEMBL51747 0.78 HTR1A (0.64) CA12CA2CA9HTR1ACYP2D6
SCHEMBL7982172 0.77 MAPT (0.47) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL304891 0.77 CXCR2 (0.54) GAACA12CA2CA9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4387210-A Process for producing aromatic polyester amide MITSUI TOATSU CHEMICAL, INC. (JP) 1983-06-07 US claimed
EP-0055480-A1 Process for producing aromatic polyester amide MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-07 EP claimed
JP-57080353-A None JP disclosed
JP-3195731-A None JP disclosed
JP-H03195731-A NEW POLYAMIDEIMIDE HITACHI CHEM CO LTD 1991-08-27 JP disclosed
US-4387210-A Process for producing aromatic polyester amide MITSUI TOATSU CHEMICAL, INC. (JP) 1983-06-07 US disclosed
US-4387210-A Process for producing aromatic polyester amide MITSUI TOATSU CHEMICAL, INC. (JP) 1983-06-07 US disclosed
EP-0055480-A1 Process for producing aromatic polyester amide MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-07 EP disclosed
EP-0055480-A1 Process for producing aromatic polyester amide MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-07 EP disclosed
JP-S5780353-A NOVEL PHTHALAMIDE DERIVATIVE AND ITS PREPARATION MITSUI TOATSU CHEM INC 1982-05-19 JP disclosed