SCHEMBL8196997

SCHEMBL8196997

CC(C)(C)c1ccc(O[PH](=O)Oc2ccc(C(C)(C)C)cc2)cc1.[NaH]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
MAPT P10636 4/20 0.45
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
MAPK1 P28482 2/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 1/20 0.41
LMNA P02545 3/20 0.41
ALOX15 P16050 1/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TYR P14679 1/20 0.39
DDB1 Q16531 1/20 0.39

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
SCHEMBL4315243 0.98 CA1 (0.48) CA1CA2CA9MAPTALDH1A1
SCHEMBL28219656 0.88 CA1 (0.44) CA1CA2CA9MAPTALDH1A1
SCHEMBL28437311 0.83 SMN1; SMN2 (0.46) CA1CA2CA9MAPTALDH1A1
SCHEMBL28854180 0.83 SMN1; SMN2 (0.46) CA1CA2CA9MAPTALDH1A1
SCHEMBL29034892 0.83 RAB9A (0.43) CA1CA2CA9MAPTALDH1A1
SCHEMBL23844032 0.82 ALDH1A1 (0.43) CA1CA2CA9MAPTALDH1A1
SCHEMBL13933659 0.81 CA1 (0.40) CA1CA2CA9MAPTALDH1A1
SCHEMBL17110496 0.81 SMN1; SMN2 (0.47) CA1CA2CA9MAPTALDH1A1
SCHEMBL28437313 0.81 CA1 (0.46) CA1CA2CA9MAPTALDH1A1
SCHEMBL4320820 0.79 CA1 (0.44) CA1CA2CA9MAPTALDH1A1

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
EP-0992522-A1 CARBONIC DIESTER, AROMATIC POLYCARBONATE, PRODUCTION APPARATUS, AND PROCESS FOR PRODUCTION TEIJIN LIMITED (JP) 2000-04-12 EP disclosed