SCHEMBL11142181

SCHEMBL11142181

CC(N(CC(O)CO)C(C)S(=O)(=O)O)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MMP1 P03956 1/20 0.31
MMP7 P09237 1/20 0.31
MMP8 P22894 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL11148353 0.83 ALDH1A1 (0.32) ALDH1A1LMNAMMP1MMP7MMP8
SCHEMBL11143354 0.80
SCHEMBL5041950 0.77 LMNA (0.42) ALDH1A1LMNATDP1
SCHEMBL5046552 0.77 LMNA (0.42) ALDH1A1LMNATDP1
SCHEMBL723158 0.77 LMNA (0.42) ALDH1A1LMNATDP1
SCHEMBL17276910 0.72
SCHEMBL6158095 0.72 LMNA (0.42) ALDH1A1LMNATDP1
SCHEMBL7622756 0.71 MAPT (0.32)
Hydrochloric Acid SCHEMBL11700049 0.70 LMNA (0.40) ALDH1A1LMNATDP1
SCHEMBL11146990 0.70 MEN1 (0.32)

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-4368287-A POLYESTER CONTAINING AMINO-SULFONIC AMPHOIONIC GROUP NIPPON PAINT CO., LTD. (JP) 1983-01-11 US disclosed
US-4328143-A Aqueous coating composition NIPPON PAINT COMPANY, LTD. (JP) 1982-05-04 US disclosed