SCHEMBL7141232

SCHEMBL7141232

C=CC(=O)NC(O)P(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL336549 0.79 TSHR (0.50) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL5489505 0.76 TSHR (0.46) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL1564157 0.76 TSHR (0.58) TSHRCYP2C19ALDH1A1MAPK1TDP1
Phosphoric Acid SCHEMBL10755154 0.73 TSHR (0.82) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL491509 0.72 TSHR (0.54) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL4108692 0.72 TSHR (0.59) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL18755249 0.72 TSHR (0.59) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL7109385 0.72
SCHEMBL20613908 0.72 TSHR (0.59) TSHRCYP2C19ALDH1A1MAPK1TDP1
SCHEMBL151457 0.72 TSHR (0.59) TSHRCYP2C19ALDH1A1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1065309-B1 METHOD FOR THE FLAME-RETARDANT PROCESSING OF TEXTILE MATERIALS ISLE FIRESTOP LTD (GB) 2003-07-30 EP disclosed