SCHEMBL7966442

SCHEMBL7966442

C=C(CC=C(C)C(=O)O)C(=O)OCCCC.C=CCOCC1CO1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 3/20 0.33
HPGD P15428 1/20 0.32

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
SCHEMBL7957619 0.92 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2TDP1TSHRHPGD
SCHEMBL7970236 0.86 TSHR (0.44) ALDH1A1SMN1; SMN2TDP1TSHRHPGD
SCHEMBL7957498 0.86 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2TDP1TSHRHPGD
SCHEMBL11785001 0.82 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2TDP1TSHR
SCHEMBL3362944 0.82 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2TDP1TSHR
SCHEMBL3670738 0.82 TSHR (0.47) ALDH1A1SMN1; SMN2TDP1TSHRHPGD
SCHEMBL7970148 0.81 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TSHR
Butadiene SCHEMBL8956976 0.81 TSHR (0.44) ALDH1A1TDP1TSHRHPGD
SCHEMBL3069536 0.79 ALDH1A1 (0.59) ALDH1A1
SCHEMBL10482155 0.79 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TDP1TSHR

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