SCHEMBL327183

SCHEMBL327183

CC(=O)CC(=O)Nc1ccc(CC(O)(OP(O)O)O[PH](=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
TSHR P16473 1/20 0.41
MAPT P10636 3/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA7 P43166 1/20 0.39
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
ATM Q13315 1/20 0.36
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL13022706 0.69 FDPS (0.31) CA1CA2CA4CA7
SCHEMBL593172 0.69 MAPT (0.74) POLBTSHRMAPTCA1CA2
SCHEMBL276157 0.69 FDPS (0.53) POLBTSHRMAPTCA1CA2
SCHEMBL10603962 0.68 POLB (0.67) POLBTSHRMAPTCA1CA2
SCHEMBL7055067 0.67 POLB (0.70) POLBTSHRMAPTCA1CA2
SCHEMBL9341609 0.66 MAPT (0.65) POLBTSHRMAPTCA1CA2
SCHEMBL12187695 0.66
SCHEMBL28779123 0.65 POLB (0.63) POLBTSHRMAPTCA1CA2
SCHEMBL11328089 0.65 POLB (0.48) POLBTSHRMAPTCA1CA2
SCHEMBL8751494 0.65 CA1 (0.64) POLBTSHRMAPTCA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133311-B2 Liquid vehicle, pigment, and non-polymeric dispersant containing diphosphate groups; ink jet inks CABOT CORPORATION (US) 2012-03-13 US disclosed
US-20080264298-A1 Pigment dipsersions comprising functionalized non-polymeric dispersants CABOT CORPORATION 2008-10-30 US disclosed