SCHEMBL8970708

SCHEMBL8970708

CC(C)(C)c1cc(C(N)[P])cc(C(C)(C)C)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 4/20 0.54
▸ CA1 P00915 2/20 0.54
▸ ALDH1A1 P00352 6/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ POLB P06746 1/20 0.52
▸ TYR P14679 1/20 0.52
▸ ALOX15 P16050 4/20 0.47
▸ MAPT P10636 3/20 0.47
▸ HPN P05981 1/20 0.47
▸ SIRT5 Q9NXA8 1/20 0.47
▸ GAA P10253 4/20 0.42
▸ LMNA P02545 3/20 0.42
▸ TSHR P16473 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ HTT P42858 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42

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
Hydrochloric Acid SCHEMBL30039183 0.85 CA2 (0.52) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL4895002 0.84 CA2 (0.56) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL11659316 0.83 CA2 (0.54) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL8970706 0.81 CA2 (0.52) CA2CA1ALDH1A1SMN1; SMN2POLB
Hydrochloric Acid SCHEMBL14603472 0.80 CA2 (0.47) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL5280803 0.80 GLRA3 (0.48) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL1597366 0.79 CA2 (0.61) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL8772288 0.79 CA2 (0.61) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL11586001 0.79 CA2 (0.50) CA2CA1ALDH1A1SMN1; SMN2POLB
SCHEMBL11407074 0.79 CA2 (0.50) CA2CA1ALDH1A1SMN1; SMN2POLB

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-0703239-A1 Aminomethylphosphonic and aminomethylphosphinic acids derivatives and their use in the treatment of degenerative articular diseases HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-27 — — EP disclosed
EP-0700923-A1 Stabilised dithiophosphoric acid disulphides RHEIN CHEMIE RHEINAU GmbH (DE) 1996-03-13 — — EP disclosed
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