SCHEMBL16079107

SCHEMBL16079107

OC1CCCCCCCCCCCC(O)C(O)C1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.50
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA4 P22748 2/20 0.39
▸ LMNA P02545 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ SLC18A3 Q16572 3/20 0.33
▸ GSR P00390 1/20 0.32
▸ DPP4 P27487 1/20 0.31
▸ DPP7 Q9UHL4 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
SCHEMBL15011725 0.97 TSHR (0.53) TSHRCA1CA2CA4LMNA
SCHEMBL2254628 0.91 TSHR (0.44) TSHRCA1CA2CA4LMNA
SCHEMBL28422261 0.85 TSHR (0.53) TSHRCA1CA2CA4LMNA
SCHEMBL9283474 0.81 TSHR (0.47) TSHRCA1CA2CA4LMNA
SCHEMBL13888941 0.81 TSHR (0.64) TSHRCA1CA2CA4LMNA
SCHEMBL10795387 0.81 TSHR (0.64) TSHRCA1CA2CA4LMNA
SCHEMBL15337087 0.81 TSHR (0.64) TSHRCA1CA2CA4LMNA
SCHEMBL15484298 0.81 TSHR (0.64) TSHRCA1CA2CA4LMNA
SCHEMBL13889159 0.81 TSHR (0.64) TSHRCA1CA2CA4LMNA
SCHEMBL2154470 0.81 TSHR (0.64) TSHRCA1CA2CA4LMNA

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
US-20140273264-A1 EPOXY CHEMISTRY DERIVED MATERIALS AS MIXED MODE CHROMATOGRAPHY MEDIA, METHOD FOR THEIR SYNTHESIS AND USE DIONEX CORPORATION 2014-09-18 — — US disclosed
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