SCHEMBL29832248

SCHEMBL29832248

CC=CC(=O)OC(CC)CC(O)COc1ccccc1C(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 19/20 0.58
▸ SCN1A P35498 1/20 0.43
▸ SCN5A Q14524 1/20 0.43
▸ SCN9A Q15858 1/20 0.43

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
SCHEMBL29832639 0.80 ABCB1 (0.56) ABCB1SCN1ASCN5ASCN9A
SCHEMBL29832400 0.73 HCAR2 (0.38) ABCB1SCN1A
SCHEMBL3985320 0.73 ABCB1 (0.64) ABCB1
SCHEMBL7754052 0.73 ABCB1 (0.69) ABCB1SCN1ASCN5ASCN9A
Hydrochloric Acid SCHEMBL9618972 0.72 ABCB1 (0.67) ABCB1SCN1ASCN5ASCN9A
SCHEMBL15512712 0.72 ABCB1 (0.48) ABCB1
SCHEMBL15463392 0.72 ABCB1 (0.60) ABCB1SCN1ASCN5ASCN9A
SCHEMBL29478062 0.72 ABCB1 (0.60) ABCB1SCN1ASCN5ASCN9A
SCHEMBL29832461 0.72 DRD2 (0.50) ABCB1
SCHEMBL27840483 0.71 ELANE (0.59) ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114836152-A Foaming resin adhesive, photocuring crosslinking rubber elastomer foam and preparation method thereof 新纶电子材料(常州)有限公司 2022-08-02 — — CN claimed
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