SCHEMBL8434896

SCHEMBL8434896

C=C(C)C(=O)NC1=CC(O)(C(C)=O)C(C(=O)O)C=C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 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
SCHEMBL4613365 0.82 ALDH1A1 (0.35) RXFP1TDP1
SCHEMBL8438101 0.78 RXFP1 (0.31) RXFP1TDP1
SCHEMBL27658512 0.71
SCHEMBL8437788 0.69 RXFP1 (0.31) RXFP1TDP1
SCHEMBL8437826 0.68 RXFP1 (0.30) RXFP1
Hydrochloric Acid SCHEMBL7679426 0.59
SCHEMBL28022284 0.58
SCHEMBL8438950 0.57
SCHEMBL6695367 0.57 RXFP1 (0.38) RXFP1TDP1
SCHEMBL11497527 0.57

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
EP-0732322-B1 Acetylsalicylic acid derivatives having a vinyl group UBE INDUSTRIES (JP) 1999-12-22 EP disclosed
US-5693320-A ANTICOAGULANTS, BIOCOMPATIBILITY, MEDICAL EQUIPMENT UBE INDUSTRIES, LTD. (JP) 1997-12-02 US disclosed
EP-0732322-A1 Acetylsalicylic acid derivatives having a vinyl group UBE INDUSTRIES, LTD. (JP) 1996-09-18 EP disclosed