SCHEMBL6150706

SCHEMBL6150706

C=CCOCC(O)COCCOCCOCCOCCOCCO

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.55
CA2 P00918 5/20 0.55
CA7 P43166 4/20 0.55
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
CA9 Q16790 4/20 0.38
CA4 P22748 3/20 0.35
USP2 O75604 1/20 0.32
CYP2D6 P10635 1/20 0.32
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL21765143 1.00 CA1 (0.55) CA1CA2CA7MEN1KMT2A
SCHEMBL10712582 1.00 CA1 (0.55) CA1CA2CA7MEN1KMT2A
SCHEMBL10709606 1.00 CA1 (0.55) CA1CA2CA7MEN1KMT2A
SCHEMBL497334 0.83 CA1 (0.74) CA1CA2CA7MEN1KMT2A
SCHEMBL3542017 0.83 MEN1 (0.61) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL5021533 0.83 MEN1 (0.61) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL18251584 0.83 MEN1 (0.61) MEN1KMT2ATSHRMAPK1USP2
SCHEMBL24179633 0.83 CA1 (0.53) CA1CA2CA7CA9CA4
SCHEMBL21727219 0.83 CA1 (0.53) CA1CA2CA7MEN1KMT2A
SCHEMBL21727225 0.83 CA1 (0.53) CA1CA2CA7MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1007178-B1 BIFUNCTIONAL CROWN ETHER-BASED CATION-EXCHANGE STATIONARY PHASE FOR LIQUID CHROMATOGRAPHY DIONEX CORP (US) 2005-01-19 EP disclosed
EP-1007178-A4 BIFUNCTIONAL CROWN ETHER-BASED CATION-EXCHANGE STATIONARY PHASE FOR LIQUID CHROMATOGRAPHY DIONEX CORP (US) 2002-03-06 EP disclosed
EP-1007178-A1 BIFUNCTIONAL CROWN ETHER-BASED CATION-EXCHANGE STATIONARY PHASE FOR LIQUID CHROMATOGRAPHY DIONEX CORPORATION (US) 2000-06-14 EP disclosed
US-5968363-A Bifunctional crown ether-based cation-exchange stationary phase for liquid chromatography DIONEX CORPORATION (US) 1999-10-19 US disclosed
US-5865994-A Bifunctional crown ether-based cation-exchange stationary phase for liquid chromatography DIONEX CORPORATION (US) 1999-02-02 US disclosed
WO-1998040144-A1 BIFUNCTIONAL CROWN ETHER-BASED CATION-EXCHANGE STATIONARY PHASE FOR LIQUID CHROMATOGRAPHY DIONEX CORPORATION (US) 1998-09-17 WO disclosed