SCHEMBL31256670

SCHEMBL31256670

O=C(O)/C=C/c1cccc(O)c1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 0.71
CA1 P00915 1/20 0.71
CA2 P00918 1/20 0.71
CA4 P22748 1/20 0.71
IAPP P10997 4/20 0.70
BACE1 P56817 1/20 0.57
ERN1 O75460 1/20 0.55
ALOX5 P09917 1/20 0.55
JUN P05412 1/20 0.52
NFE2L2 Q16236 1/20 0.52
PTGER1 P34995 1/20 0.50
PTGER4 P35408 1/20 0.50
PTGER3 P43115 1/20 0.50
PTGER2 P43116 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MAPT P10636 2/20 0.48
LMNA P02545 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL31083592 1.00 NFKB1 (0.71) NFKB1CA1CA2CA4IAPP
SCHEMBL307296 1.00 NFKB1 (0.71) NFKB1CA1CA2CA4IAPP
SCHEMBL89185 1.00 NFKB1 (0.71) NFKB1CA1CA2CA4IAPP
SCHEMBL12189733 0.85 IAPP (0.66) NFKB1CA1CA2CA4IAPP
SCHEMBL9094389 0.84 NFKB1 (0.66) NFKB1CA1CA2CA4IAPP
O-Coumaric Acid SCHEMBL29368085 0.83 NFKB1 (1.00) NFKB1CA1CA2CA4JUN
O-Coumaric Acid SCHEMBL892006 0.83 NFKB1 (1.00) NFKB1CA1CA2CA4JUN
O-Coumaric Acid SCHEMBL29367602 0.83 NFKB1 (1.00) NFKB1CA1CA2CA4JUN
O-Coumaric Acid SCHEMBL64885 0.83 NFKB1 (1.00) NFKB1CA1CA2CA4JUN
O-Coumaric Acid SCHEMBL29353381 0.83 NFKB1 (1.00) NFKB1CA1CA2CA4JUN

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-119032076-A Novel compounds and uses thereof 株式会社安提昂 2024-11-26 CN disclosed