SCHEMBL26100784

SCHEMBL26100784

CC(C)(C)[Si](OCCCC(N)=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 2/20 0.38
CYP3A4 P08684 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LTB4R Q15722 1/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LTA4H P09960 1/20 0.36
PPARA Q07869 2/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
PDK2 Q15119 1/20 0.34
NR4A2 P43354 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL5847918 0.95 LTB4R (0.41) SMYD2CYP3A4HTTSMN1; SMN2LTB4R
SCHEMBL4271454 0.89 SMYD2 (0.38) SMYD2CYP3A4HTTSMN1; SMN2LTB4R
SCHEMBL12192743 0.89 ALDH1A1 (0.40) SMYD2CYP3A4HTTSMN1; SMN2LTB4R
SCHEMBL12921004 0.88 SMYD2 (0.42) SMYD2CYP3A4HTTSMN1; SMN2LTB4R
SCHEMBL5136846 0.87 SOAT1 (0.43) CYP3A4LTB4RPPARAKMT2A
SCHEMBL14265480 0.87 SOAT1 (0.43) CYP3A4LTB4RPPARAKMT2A
SCHEMBL8403713 0.87 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2LTB4R
SCHEMBL26102243 0.87 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2LMNA
SCHEMBL12503798 0.85 LMNA (0.49) SMYD2CYP3A4HTTSMN1; SMN2LMNA
SCHEMBL26100458 0.85 LMNA (0.42) CYP3A4HTTSMN1; SMN2LTB4RLMNA

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
WO-2023076849-A1 INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR ORIC PHARMACEUTICALS, INC. (US) 2023-05-04 WO disclosed