SCHEMBL21836022

SCHEMBL21836022

CCCCC(O)(O)C(C)(N)O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 12/20 0.43
SMPD1 P17405 4/20 0.35
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
GGPS1 O95749 6/20 0.33
ALDH1A1 P00352 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
SCHEMBL21086309 0.78 ESR1 (0.38) FDPSESR1ESR2GGPS1ALDH1A1
SCHEMBL3421034 0.78
SCHEMBL14844470 0.78 ESR1 (0.38) FDPSESR1ESR2GGPS1ALDH1A1
Hydrochloric Acid SCHEMBL11320963 0.76
SCHEMBL1272523 0.75
SCHEMBL1129566 0.75
SCHEMBL14840328 0.75 FDPS (0.48) FDPSSMPD1ESR1ESR2GGPS1
SCHEMBL2349836 0.75 ESR1 (0.39) FDPSESR1ESR2GGPS1ALDH1A1
SCHEMBL5694463 0.74 ESR1 (0.35) FDPSESR1ESR2GGPS1ALDH1A1
SCHEMBL29141431 0.74 FDPS (0.43) FDPSSMPD1ESR1ESR2GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3104982-B1 AMINO ALCOHOL TREATMENT FOR SOL-GEL CONVERSION COATINGS, SUBSTRATES INCLUDING THE SAME, AND METHODS OF MAKING THE SUBSTRATES PRC DESOTO INT INC (US) 2020-04-08 EP claimed
CN-110066991-B Aminoalcohol treatment for sol-gel conversion coatings, substrates comprising the coatings, and methods of making the substrates PRC-迪索托国际公司 2021-08-03 CN disclosed