SCHEMBL31035129

SCHEMBL31035129

CC1(C)OB(c2cccc(O)c2C=O)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.36
CA2 P00918 7/20 0.36
CA9 Q16790 6/20 0.36
CA12 O43570 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
JAK2 O60674 3/20 0.34
BTK Q06187 3/20 0.34
ERN1 O75460 5/20 0.34
LIPG Q9Y5X9 3/20 0.34
LPL P06858 2/20 0.34
P4HB P07237 1/20 0.34
TRIM24 O15164 1/20 0.32
TRIM33 Q9UPN9 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
SCHEMBL31035894 0.82 JAK2 (0.35) CA1CA2CA9CA12CA3
SCHEMBL16166532 0.81 MEN1 (0.50) CA1CA2CA9CA12CA3
SCHEMBL13183401 0.81 JAK2 (0.42) CA1CA2CA9CA12CA3
SCHEMBL31562211 0.81 CA1 (0.36) CA1CA2CA9CA12CA3
SCHEMBL31035400 0.79 ERN1 (0.37) CA1CA2CA9CA12CA3
SCHEMBL31035690 0.78 LPL (0.35) CA1CA2CA9CA12CA3
SCHEMBL31035871 0.78 CA1 (0.34) CA1CA2CA9CA12CA3
SCHEMBL333869 0.77 LPL (0.46) CA1CA2CA9CA12CA3
SCHEMBL3203922 0.76 JAK2 (0.42) CA1CA2CA9CA12CA3
SCHEMBL31035610 0.76 CA1 (0.40) CA1CA2CA9CA12CA3

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
EP-4680612-A1 CHEMICAL COMPOUNDS AN2 Therapeutics, Inc. (US) 2026-01-21 EP disclosed
WO-2024192309-A1 CHEMICAL COMPOUNDS REACTIVE BIOSCIENCES, INC. (US) 2024-09-19 WO disclosed