SCHEMBL23710673

SCHEMBL23710673

O=C(O[C@@H]1C(=O)OCC1O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
HSD17B10 Q99714 1/20 0.42
BCHE P06276 1/20 0.42
CHRNA7 P36544 2/20 0.41
PPM1B O75688 1/20 0.40
GRM5 P41594 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
F2 P00734 1/20 0.40
LMNA P02545 1/20 0.40
LGALS9 O00182 1/20 0.40
LGALS1 P09382 1/20 0.40
LGALS3 P17931 1/20 0.40
LGALS7; LGALS7B P47929 1/20 0.40
GAA P10253 1/20 0.40
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39

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
SCHEMBL18202479 1.00 MEN1 (0.42) MEN1KMT2AMAPTHSD17B10BCHE
SCHEMBL24772411 1.00 MEN1 (0.42) MEN1KMT2AMAPTHSD17B10BCHE
SCHEMBL9618911 0.84 BCHE (0.48) MEN1KMT2AMAPTHSD17B10BCHE
SCHEMBL9921160 0.84 BCHE (0.48) MEN1KMT2AMAPTHSD17B10BCHE
SCHEMBL18288604 0.83 TRPM8 (0.45) MEN1KMT2AMAPTHSD17B10BCHE
SCHEMBL1751897 0.76 LMNA (0.48) MEN1KMT2AMAPTHSD17B10CHRNA7
SCHEMBL637664 0.76 LMNA (0.48) MEN1KMT2AMAPTHSD17B10CHRNA7
SCHEMBL636837 0.76 LMNA (0.48) MEN1KMT2AMAPTHSD17B10CHRNA7
SCHEMBL20067804 0.74 BCHE (0.40) MEN1KMT2AMAPTHSD17B10BCHE
SCHEMBL16140946 0.74 BCHE (0.50) MEN1KMT2ABCHECHRNA7GAA

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
US-20210238595-A1 MODIFIED RNA AGENTS WITH REDUCED OFF-TARGET EFFECT ALNYLAM PHARMACEUTICALS, INC. (US) 2021-08-05 US disclosed