SCHEMBL9583151

SCHEMBL9583151

CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OCn1cnc2c(NC)nc(NC)nc21

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HDAC1 Q13547 3/20 0.39
▸ HDAC2 Q92769 3/20 0.39
▸ PRKCA P17252 1/20 0.38
▸ PRKCE Q02156 1/20 0.38
▸ PRKCQ Q04759 1/20 0.38
▸ PRKCD Q05655 1/20 0.38
▸ PDE3A Q14432 1/20 0.37
▸ P2RY1 P47900 2/20 0.37

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
SCHEMBL9584373 0.95 PDE3A (0.43) ALDH1A1LMNAHDAC1HDAC2PRKCA
SCHEMBL9583048 0.90 PDE3A (0.40) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL9583144 0.90 PDE3A (0.40) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL9583789 0.90 HDAC1 (0.49) HDAC1HDAC2P2RY1
SCHEMBL9583957 0.90 ABCB1 (0.41) ALDH1A1LMNAHDAC1HDAC2PRKCA
SCHEMBL9583472 0.87 P2RY1 (0.46) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL9584187 0.86 P2RY1 (0.50) HDAC1HDAC2P2RY1
SCHEMBL10818024 0.85 PDE3A (0.35) ALDH1A1LMNAPDE3AP2RY1
SCHEMBL9583122 0.85 PDE3A (0.47) ALDH1A1LMNAHDAC1HDAC2PRKCA
SCHEMBL9583322 0.84 PDE3A (0.41) ALDH1A1LMNAHDAC1HDAC2PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5250535-A Herpes virus; nontoxic; side effect reduction; humans and veterinary medicine SYNTEX INC. (US) 1993-10-05 — — US disclosed
US-4803271-A Process for preparing guanine derivatives SYNTEX (U.S.A.) INC. (US) 1989-02-07 — — US disclosed
US-4612314-A Substituted 9-(1 or 3-monoacyloxy or 1,3-diacyloxy-2-propoxymethyl) purines as antiviral agent SYNTEX (U.S.A.) INC. (US) 1986-09-16 — — US disclosed
EP-0085424-A2 Substituted 9-(1 or 3-monoacyloxy or 1,3-diacyloxy-2-propoxymethyl)purines as antiviral agent SYNTEX (U.S.A.) INC. (US) 1983-08-10 — — EP disclosed
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