SCHEMBL25014158

SCHEMBL25014158

Cc1cccc(C)c1OP1(=O)OCC(CBr)(CBr)CO1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL13816566 0.79 ALDH1A1 (0.30) SMN1; SMN2
SCHEMBL13816563 0.77 MAPK1 (0.35)
SCHEMBL25014900 0.73 CYP3A4 (0.35) SMN1; SMN2KDM4E
SCHEMBL25014153 0.73 HTR1B (0.36) KDM4E
SCHEMBL25014156 0.72 PPARG (0.33)
SCHEMBL25014155 0.71 ALOX5 (0.40) SMN1; SMN2KDM4E
SCHEMBL25014163 0.70
SCHEMBL25014160 0.70 TSHR (0.34)
SCHEMBL13816565 0.69
SCHEMBL25014161 0.67

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-2023007982-A1 PHOSPHORUS COMPOUND HAVING ISOCYANURATE RING, SYNTHETIC METHOD THEREFOR, AND USE OF SAID PHOSPHORUS COMPOUND HAVING ISOCYANURATE RING 四国化成工業株式会社 2023-02-02 WO disclosed