SCHEMBL8824889

SCHEMBL8824889

CCC(O)P(C(O)CC)C(O)CC.O=PO

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33

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
SCHEMBL386280 0.85 TSHR (0.44) TSHR
SCHEMBL8000848 0.82 TSHR (0.41) TSHR
Phosphine SCHEMBL5568847 0.82 TSHR (0.41) TSHR
SCHEMBL8010115 0.82 TSHR (0.41) TSHR
SCHEMBL8824778 0.79 CHRM1 (0.33) TSHR
Phosphoric Acid SCHEMBL8824868 0.78 LAP3 (0.40) TSHR
Phosphoric Acid SCHEMBL8824878 0.78 LAP3 (0.40) TSHR
Hypophosphorous Acid SCHEMBL8824894 0.78 TSHR (0.33) TSHR
Acetic Acid SCHEMBL8010204 0.74 CA1 (0.40) TSHR
Acetic Acid SCHEMBL8009674 0.74 CA1 (0.40) TSHR

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
US-5695528-A AGENT COMPRISING WATER SOLUBLE PHOSPHONIUM SALT OF PHOSPHORUS-CONTAINING OXOACID, POLYCARBOXYLIC ACID; FORMALDEHYDE-FREE WASH AND WEAR TREATMENT NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 1997-12-09 US disclosed