SCHEMBL8617023

SCHEMBL8617023

CC(O)N(CC(O)CN(C(C)O)C(C)O)C(C)O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 2/20 0.31
LMNA P02545 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
SCHEMBL6158095 0.85 LMNA (0.42) TSHRTDP1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL11700049 0.83 LMNA (0.40) TSHRTDP1ALDH1A1LMNA
SCHEMBL5717252 0.83 GABRR1 (0.34) TSHRALDH1A1LMNA
SCHEMBL1934992 0.80 TSHR (0.39) TSHRTDP1ALDH1A1LMNA
SCHEMBL339999 0.80 CA12 (0.38) TSHRTDP1ALDH1A1LMNA
SCHEMBL10745309 0.77 CYP3A4 (0.33) TSHR
SCHEMBL1635254 0.75 SLC22A6 (0.32)
SCHEMBL10434814 0.75
SCHEMBL6552664 0.74 GPR84 (0.47) LMNA
SCHEMBL10952202 0.74 GPR84 (0.47) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0688267-B1 IMPROVED INK-RECEPTIVE SHEET MINNESOTA MINING & MFG (US) 1998-07-22 EP disclosed
US-5712027-A SHELF LIFE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-01-27 US disclosed
EP-0688265-B1 IMPROVED INK-RECEPTIVE SHEET MINNESOTA MINING & MFG (US) 1997-06-04 EP disclosed
US-5589269-A POLYMERIC MORDANT MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-12-31 US disclosed
US-5342688-A Contains at least one polymeric mordant with a guanidine functionality MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-08-30 US disclosed