SCHEMBL27804362

SCHEMBL27804362

C=C(C)C(=O)OCCSc1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 1/20 0.46
▸ CNR2 P34972 2/20 0.45
▸ MAPT P10636 5/20 0.43
▸ GAA P10253 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ STAT3 P40763 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42
▸ HDAC5 Q9UQL6 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ HTT P42858 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
SCHEMBL2392778 0.83 MTNR1A (0.50) MAPTPOLBAPEX1HTTTDP1
SCHEMBL29137795 0.83 PTGS2 (0.36) CNR2POLBAPEX1HTTTDP1
SCHEMBL24565137 0.81 MTNR1A (0.60) LMNAALDH1A1THRB
SCHEMBL3134843 0.80 THRB (0.43) MAPTLMNAPOLBAPEX1HTT
SCHEMBL24565135 0.80 MTNR1A (0.40) MAPTLMNAPOLBAPEX1HTT
SCHEMBL24565138 0.79 MTNR1A (0.56) MAPTLMNAPOLBAPEX1HTT
SCHEMBL24565132 0.79 ALDH1A1 (0.45) MAPTGAALMNAPOLBAPEX1
SCHEMBL10050686 0.79 ELANE (0.55) MAPTGAAPOLBAPEX1HTT
SCHEMBL1491949 0.78 THRB (0.51) ANPEPCNR2MAPTGAALMNA
SCHEMBL5266032 0.78 CYP1A2 (0.48) MAPTLMNAHDAC1HDAC8POLB

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
CN-101981477-B Adhesive layer for multilayer optical film 3M INNOVATIVE PROPERTIES CO 2012-10-10 — — CN claimed
CN-101981477-A Adhesive layer for multilayer optical film 3M INNOVATIVE PROPERTIES CO 2011-02-23 — — CN claimed
Send feedback