SCHEMBL9751356

SCHEMBL9751356

NCCCC[C@H](N)C(=O)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 1/20 0.57
▸ CCNB1 P14635 1/20 0.57
▸ LDHA P00338 1/20 0.42
▸ EPHX2 P34913 3/20 0.40
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ TLR4 O00206 1/20 0.35
▸ PRKD3 O94806 1/20 0.32
▸ PRKCG P05129 1/20 0.32
▸ PRKCB P05771 1/20 0.32
▸ PRKCA P17252 1/20 0.32
▸ PRKCH P24723 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ PRKCE Q02156 1/20 0.32
▸ PRKCQ Q04759 1/20 0.32
▸ PRKCZ Q05513 1/20 0.32
▸ PRKCD Q05655 1/20 0.32
▸ PRKD1 Q15139 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 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
Hydrochloric Acid SCHEMBL28809992 0.99 CDK1 (0.59) CDK1CCNB1LDHAEPHX2CA2
Sucrose SCHEMBL9751350 0.89 CDK1 (0.57) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL27633793 0.87 CDK1 (0.58) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL5705134 0.87 CDK1 (0.58) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL526998 0.86 CDK1 (0.56) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL20338626 0.86 CDK1 (0.52) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL3568637 0.85 CDK1 (0.60) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL8734449 0.85 CDK1 (0.60) CDK1CCNB1LDHAEPHX2CA2
Hydrochloric Acid SCHEMBL28864198 0.85 CDK1 (0.53) CDK1CCNB1LDHAEPHX2CA2
SCHEMBL2592322 0.84 CDK1 (0.59) CDK1CCNB1LDHAEPHX2CA2

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-5068106-A Tissue plasminogen activator in protein solution BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1991-11-26 — — US disclosed
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