SCHEMBL9667604

SCHEMBL9667604

Cc1cccc(C2=C(c3cccc(C)c3)C(=O)OC2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
ALDH1A1 P00352 3/20 0.49
HPGD P15428 2/20 0.49
TP53 P04637 2/20 0.49
CYP3A4 P08684 2/20 0.49
MAPK1 P28482 2/20 0.49
MAOB P27338 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NOTUM Q6P988 1/20 0.47
ACHE P22303 1/20 0.46
RAB9A P51151 3/20 0.44
PTGS2 P35354 2/20 0.44
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.44
KMO O15229 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL6338495 0.79 KMT2A (0.56) PTGS2SMN1; SMN2KMT2A
SCHEMBL8167493 0.77 GSK3B (0.54)
SCHEMBL31471473 0.75 ACHE (0.69) ALDH1A1HPGDMAPK1ACHERAB9A
SCHEMBL29373699 0.75 ACHE (0.69) ALDH1A1HPGDMAPK1ACHERAB9A
SCHEMBL301247 0.75 ACHE (0.69) ALDH1A1HPGDMAPK1ACHERAB9A
SCHEMBL1471565 0.75 MAPT (0.46) MAPTALDH1A1HPGDTP53CYP3A4
SCHEMBL10980169 0.75 PTGS2 (0.53) HPGDMAOBHSD17B10TDP1NOTUM
SCHEMBL19577801 0.73 ACHE (0.65) ALDH1A1HPGDMAPK1ACHERAB9A
SCHEMBL18797759 0.73 ACHE (0.65) ALDH1A1HPGDMAPK1ACHERAB9A
SCHEMBL3729848 0.72 CAMK2D (0.44) NOTUMACHEPTGS2L3MBTL1XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5098991-A Process of preparing polyamide-imide and polyimide polymers from acid anhydrides and dianhydrides of disubstituted maleic anhydrides AMOCO CORPORATION (US) 1992-03-24 US disclosed
US-5003085-A Acid anhydrides and dianhydrides of disubstituted maleic anhydrides AMOCO CORPORATION (US) 1991-03-26 US disclosed