SCHEMBL4620069

SCHEMBL4620069

CC(=O)CC(=O)c1ccccc1.CC(=O)CC(=O)c1ccccc1.CC(=O)CC(=O)c1ccccc1.[Eu].c1cnc2c(c1)ccc1ncccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
CYP3A4 P08684 2/20 0.43
KDR P35968 1/20 0.43
EGLN1 Q9GZT9 2/20 0.42
PABPC1 P11940 1/20 0.41
ADORA3 P0DMS8 2/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CTNNB1 P35222 1/20 0.40
WNT3A P56704 1/20 0.40
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PLOD2 O00469 2/20 0.40

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
SCHEMBL28036598 1.00 LMNA (0.56) LMNACYP3A4KDREGLN1PABPC1
Acrylic Acid SCHEMBL27875841 0.93 LMNA (0.49) LMNACYP3A4KDREGLN1PABPC1
Dibenzoylmethane SCHEMBL27683419 0.92 LMNA (0.62) LMNACYP3A4KDREGLN1PABPC1
Dibenzoylmethane SCHEMBL1969521 0.92 LMNA (0.62) LMNACYP3A4KDREGLN1PABPC1
Dibenzoylmethane SCHEMBL2479758 0.91 LMNA (0.64) LMNACYP3A4KDREGLN1PABPC1
Dibenzoylmethane SCHEMBL27729815 0.91 LMNA (0.64) LMNACYP3A4KDREGLN1PABPC1
Dibenzoylmethane SCHEMBL28343728 0.90 LMNA (0.62) LMNACYP3A4KDREGLN1PABPC1
SCHEMBL28409497 0.86 LMNA (0.68) LMNACYP3A4EGLN1ALDH1A1SMN1; SMN2
SCHEMBL28926538 0.86 LMNA (0.68) LMNACYP3A4EGLN1ALDH1A1SMN1; SMN2
Acetic Acid SCHEMBL9177085 0.83 LMNA (0.77) LMNACYP3A4EGLN1ALDH1A1SMN1; SMN2

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
EP-1883124-A1 Organic light emitting material formulation IEE INTERNATIONAL ELECTRONICS & ENGINEERING S.A. (LU) 2008-01-30 EP claimed
EP-1883124-A1 Organic light emitting material formulation IEE INTERNATIONAL ELECTRONICS & ENGINEERING S.A. (LU) 2008-01-30 EP disclosed