SCHEMBL24423723

SCHEMBL24423723

CCOC1(O)CCC2(CC1)OCCO2

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL1496435 0.82
SCHEMBL15967598 0.73 KMT2A (0.37) KMT2AALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL28508385 0.73
SCHEMBL11198457 0.72
SCHEMBL22228986 0.72
SCHEMBL12312029 0.71 KMT2A (0.37) KMT2AALDH1A1POLBLMNAMAPK1
SCHEMBL18789283 0.71 ALDH1A1 (0.43) KMT2AALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL7069432 0.70 SMN1; SMN2 (0.38)
SCHEMBL24580648 0.69 ALDH1A1 (0.42) KMT2AALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL12000009 0.68 KMT2A (0.39) KMT2AALDH1A1LMNAMAPK1

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-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 WO disclosed