SCHEMBL9420249

SCHEMBL9420249

CC(O)(C(=O)O)C(=O)c1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
MAPT P10636 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
MAOA P21397 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
EPHX2 P34913 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HIF1A Q16665 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
APEX1 P27695 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP19A1 P11511 1/20 0.38
ESRRG P62508 1/20 0.37

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
SCHEMBL14889092 0.81 CES1 (0.52) LMNAMAPTCYP3A4KDM4EMEN1
SCHEMBL20912911 0.81 MAPT (0.42) LMNAMAPTCYP1A2CYP3A4MAOA
SCHEMBL4967698 0.81 CES1 (0.52) LMNAMAPTCYP3A4KDM4EMEN1
SCHEMBL8223282 0.80 CES1 (0.46) MAPTCYP1A2NPC1RAB9ACA2
SCHEMBL14889163 0.80 ALOX15 (0.50) MAPTCYP1A2CYP3A4NPC1RAB9A
SCHEMBL14889160 0.80 ALOX15 (0.50) MAPTCYP1A2CYP3A4NPC1RAB9A
SCHEMBL1176747 0.79 LMNA (0.45) LMNAMAPTCYP1A2CYP3A4MAOA
SCHEMBL4877049 0.77 LMNA (0.44) LMNAMAPTCYP1A2CYP3A4MAOA
SCHEMBL9115535 0.77 LMNA (0.44) LMNAMAPTCYP1A2CYP3A4MAOA
Aminobenzoic Acid SCHEMBL28344387 0.75 TSHR (0.52) LMNACYP1A2CYP3A4MAOAMEN1

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
EP-0518062-A1 Polymer alloys prepared in-situ, and composites containing microfibers REHAU AG + Co (DE) 1992-12-16 EP claimed
EP-0518062-B1 Polymer alloys prepared in-situ, and composites containing microfibers REHAU AG & CO (DE) 1994-12-28 EP disclosed
EP-0518062-A1 Polymer alloys prepared in-situ, and composites containing microfibers REHAU AG + Co (DE) 1992-12-16 EP disclosed