SCHEMBL28697809

SCHEMBL28697809

OCCC(S)[C@@H](O)[C@H](O)CS

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
NR1I2 O75469 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
THRB P10828 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
SCHEMBL5607582 0.84
SCHEMBL8653033 0.73
SCHEMBL10802291 0.71 THRB (0.39) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL20239632 0.71 LMNA (0.39) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL20239655 0.71 LMNA (0.44) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL1286154 0.69 LMNA (0.40) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL756618 0.67 LMNA (0.59) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL10620808 0.67 LMNA (0.69) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL5052085 0.67 LMNA (0.59) LMNANR1I2ALDH1A1CYP1A2HTT
SCHEMBL5028006 0.67 LMNA (0.59) LMNANR1I2ALDH1A1CYP1A2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114108043-B Repairing and regenerating pretreatment method for rusted area of steel structure bridge 山东省路桥集团有限公司 2023-08-11 CN claimed
CN-114108043-A Repairing and regenerating pretreatment method for rusty area of steel structure bridge 山东省路桥集团有限公司 2022-03-01 CN claimed
CN-114108043-B Repairing and regenerating pretreatment method for rusted area of steel structure bridge 山东省路桥集团有限公司 2023-08-11 CN disclosed
CN-114108043-A Repairing and regenerating pretreatment method for rusty area of steel structure bridge 山东省路桥集团有限公司 2022-03-01 CN disclosed