SCHEMBL23749240

SCHEMBL23749240

CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2c(C(=O)OC(C)(C)C)cccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 3/20 0.43
HTT P42858 2/20 0.43
LMNA P02545 2/20 0.43
USP2 O75604 1/20 0.43
CYP3A4 P08684 2/20 0.39
HPGD P15428 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
HSD17B10 Q99714 2/20 0.39
HIF1A Q16665 1/20 0.39
FTO Q9C0B1 8/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
SMAD3 P84022 1/20 0.38
PRMT1 Q99873 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
CYP2C9 P11712 1/20 0.37

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
SCHEMBL23749241 0.87 FTO (0.53) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23764900 0.85 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23749243 0.82 MEN1 (0.45) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23749242 0.76 MAPT (0.39) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL4230526 0.74 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL6850491 0.74 FTO (0.60) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23749237 0.74 PDK2 (0.33) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23764913 0.73 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL25061691 0.73 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AMAPTHTT
SCHEMBL23002141 0.73 FTO (0.55) ALDH1A1MEN1KMT2AMAPTHTT

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
US-20230104281-A1 FLUORESCENT RHODAMINE DYES WITH ENHANCED CELL PERMEABILITY MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E. V. (DE) 2023-04-06 US disclosed
EP-3865544-A1 FLUORESCENT RHODAMINE DYES WITH ENHANCED CELL PERMEABILITY Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2021-08-18 EP disclosed