SCHEMBL9716315

SCHEMBL9716315

CCCCCCCCCCCCCCCCCCOCC(CSCCCCCOCCCCCO)Oc1ncccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 3/20 0.40
PRKCG P05129 3/20 0.40
PRKCB P05771 3/20 0.40
PRKCA P17252 3/20 0.40
PRKCH P24723 3/20 0.40
PRKCI P41743 3/20 0.40
PRKCE Q02156 3/20 0.40
PRKCQ Q04759 3/20 0.40
PRKCZ Q05513 3/20 0.40
PRKCD Q05655 3/20 0.40
PRKD1 Q15139 3/20 0.40
HTT P42858 2/20 0.36
MEN1 O00255 1/20 0.36
THRB P10828 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.36
USP2 O75604 1/20 0.36
PLA2G4B P0C869 2/20 0.35
TLR2 O60603 3/20 0.34
LPAR1 Q92633 5/20 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
SCHEMBL9716269 0.95 PRKD3 (0.37) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9716244 0.92 USP2 (0.38) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9716227 0.91 MEN1 (0.42) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9716335 0.89 MEN1 (0.40) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9716304 0.83 PLA2G4B (0.36) HTTUSP2PLA2G4BTLR2LPAR1
Hydrochloric Acid SCHEMBL9716276 0.82 PRKD3 (0.47) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL10385452 0.82 MEN1 (0.54) HTTMEN1THRBKMT2AMAPT
SCHEMBL9720214 0.82 MEN1 (0.54) HTTMEN1THRBKMT2AMAPT
Hydrochloric Acid SCHEMBL9716239 0.81 PRKD3 (0.46) PRKD3PRKCGPRKCBPRKCAPRKCH
SCHEMBL9716268 0.81 MEN1 (0.41) HTTMEN1THRBKMT2AMAPT

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
US-5103007-A Antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-04-07 US disclosed
EP-0378763-A1 Lipids, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-07-25 EP disclosed