SCHEMBL25014153

SCHEMBL25014153

O=P1(Oc2cccc3ccccc23)OCC(CBr)(CBr)CO1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 8/20 0.36
HTR1D P28221 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.33
OGG1 O15527 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL13697357 0.82 ALDH1A1 (0.38) HTR1BHTR1DKDM4EALDH1A1HPGD
SCHEMBL13697359 0.80 HTR1B (0.41) HTR1BHTR1DKMT2AMEN1
SCHEMBL25014155 0.77 ALOX5 (0.40) KDM4EALDH1A1HPGDTDP1KMT2A
SCHEMBL25014895 0.75 HPGD (0.33) KDM4EALDH1A1HPGDHSD17B10ATM
SCHEMBL25014158 0.73 SMN1; SMN2 (0.32) KDM4E
SCHEMBL25014156 0.72 PPARG (0.33) ALDH1A1HPGDRAB9A
SCHEMBL11700555 0.70 ALDH1A1 (0.40) HTR1BHTR1DKDM4EALDH1A1HPGD
SCHEMBL25014160 0.70 TSHR (0.34) ALDH1A1TDP1KMT2AMEN1L3MBTL1
SCHEMBL27787426 0.64 HTR1B (0.52) HTR1BHTR1DKDM4EALDH1A1HPGD
SCHEMBL25014163 0.64

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