SCHEMBL7957773

SCHEMBL7957773

C=C(CC=C(C)C(=O)O)C(=O)OCc1ccccc1.C=CC(=O)OCC1CO1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.40
ALDH1A1 P00352 2/20 0.39
PREP P48147 1/20 0.35

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
SCHEMBL2222635 0.90 ALDH1A1 (0.52) MGLLALDH1A1PREP
SCHEMBL7966439 0.90 MGLL (0.40) MGLLALDH1A1PREP
SCHEMBL7958391 0.85 MGLL (0.43) MGLL
SCHEMBL7968697 0.84 ALDH1A1 (0.45) MGLLALDH1A1
Acrylic Acid SCHEMBL3104873 0.84 ALDH1A1 (0.45) ALDH1A1
SCHEMBL189711 0.84 ALDH1A1 (0.50) ALDH1A1
SCHEMBL10336731 0.82 ALDH1A1 (0.41) ALDH1A1
SCHEMBL7970236 0.81 TSHR (0.44) MGLLALDH1A1
SCHEMBL865165 0.80 THRB (0.38) ALDH1A1
SCHEMBL3004576 0.80 ALDH1A1 (0.42) MGLLALDH1A1PREP

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-6180691-B1 MIXING AN INK VEHICLE, A COLORANT AND A LATEX CONTAINING A POLYMER WITH EPOXY GROUPS, WHICH IS GENERATED BY POLYMERIZING A MIXTURE OF OLEFINIC MONOMERS AND AN UNSATURATED MONOMER CONTAINING EPOXIDE IN PRESENCE OF ANIONIC/NONIONIC XEROX CORPORATION 2001-01-30 US claimed
US-6180691-B1 MIXING AN INK VEHICLE, A COLORANT AND A LATEX CONTAINING A POLYMER WITH EPOXY GROUPS, WHICH IS GENERATED BY POLYMERIZING A MIXTURE OF OLEFINIC MONOMERS AND AN UNSATURATED MONOMER CONTAINING EPOXIDE IN PRESENCE OF ANIONIC/NONIONIC XEROX CORPORATION 2001-01-30 US disclosed