SCHEMBL26645908

SCHEMBL26645908

CC(c1ccccc1)N1C[C@H](O)C[C@H]1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.47
CHRM2 P08172 3/20 0.46
CHRM4 P08173 3/20 0.46
CHRM5 P08912 3/20 0.46
CHRM1 P11229 3/20 0.46
CHRM3 P20309 3/20 0.46
PIK3CD O00329 2/20 0.43
ATM Q13315 1/20 0.42
CYP2D6 P10635 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
AGTR2 P50052 1/20 0.38
ACE P12821 1/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL5379742 0.85 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL295762 0.85 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL5379214 0.85 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL5379789 0.85 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL5385064 0.85 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL23532889 0.85 KMT2A (0.42) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL23533055 0.85 KMT2A (0.42) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL23533054 0.85 KMT2A (0.42) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL29245127 0.85 KMT2A (0.42) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL23532892 0.85 KMT2A (0.42) KMT2ACHRM2CHRM4CHRM5CHRM1

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
EP-4038060-B1 DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR PFIZER (US) 2023-11-15 EP disclosed