SCHEMBL8319769

SCHEMBL8319769

O=S(=O)(O)C1(O)CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL11585425 0.97 ALDH1A1 (0.31) ALDH1A1
SCHEMBL25476022 0.97 NPSR1 (0.31) NPSR1
Water SCHEMBL11586500 0.95 ALDH1A1 (0.35) ALDH1A1
SCHEMBL2473616 0.76 ALDH1A1 (0.35) ALDH1A1
SCHEMBL28187980 0.74 TSHR (0.33) ALDH1A1
Hydrochloric Acid SCHEMBL21598030 0.74 NPSR1 (0.33) ALDH1A1NPSR1
Sulfuric Acid SCHEMBL6381423 0.73 CA5A (0.38) ALDH1A1NPSR1
SCHEMBL28059858 0.73 GAA (0.36) NPSR1
SCHEMBL11452245 0.73 GAA (0.36) NPSR1
SCHEMBL11585423 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880169-A HAVING HIGH RESOLUTION FOR FINE PATTERNING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-09 US claimed
CN-117486794-A Polysubstituted quinoline derivative and synthetic method and application thereof 华东师范大学 2024-02-02 CN disclosed
US-5880169-A HAVING HIGH RESOLUTION FOR FINE PATTERNING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-09 US disclosed