SCHEMBL29242002

SCHEMBL29242002

C=CC(=O)Oc1cc(OC)c(O)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.48
LMNA P02545 2/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
CYP3A4 P08684 3/20 0.47
CYP2B6 P20813 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
PTGS2 P35354 2/20 0.46
PTGS1 P23219 1/20 0.46

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
SCHEMBL27518941 0.85 MEN1 (0.50) CYP3A4CYP1A2MAPTKMT2AGAA
SCHEMBL28518392 0.83 MAPT (0.49) LMNAMAPTKMT2AGAASMN1; SMN2
SCHEMBL6767181 0.81 TRPA1 (0.53) PKMLMNACA12CA1CA2
SCHEMBL28393758 0.80 ALDH1A1 (0.48) CYP3A4CYP1A2CYP2D6CYP2C9MAPT
SCHEMBL27529057 0.80 CA12 (0.53) LMNACA12CA1CA2CA4
SCHEMBL34463683 0.79 TNKS (0.57) CYP3A4PTGS1KMT2ANPC1MET
SCHEMBL7041914 0.79 LMNA (0.59) PKMLMNACA12CA1CA2
SCHEMBL25311659 0.77 PKM (0.53) PKMLMNACA12CA1CA2
SCHEMBL31648375 0.77 TUBB1 (0.49) LMNACYP3A4CYP1A2MAPTKMT2A
SCHEMBL28470559 0.77 TUBB1 (0.49) LMNACYP3A4CYP1A2MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118266572-A Application of 3-methoxyphenyl-2-acrylic compound as bitter taste inhibitor 华南理工大学 2024-07-02 CN claimed
CN-118266572-A Application of 3-methoxyphenyl-2-acrylic compound as bitter taste inhibitor 华南理工大学 2024-07-02 CN disclosed
CN-118266572-A Application of 3-methoxyphenyl-2-acrylic compound as bitter taste inhibitor 华南理工大学 2024-07-02 CN disclosed