SCHEMBL9584367

SCHEMBL9584367

CNc1nc(N)c2ncn(COC(CO)CO)c2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BLM P54132 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ NFKB1 P19838 1/20 0.56
▸ VCP P55072 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ HIF1A Q16665 1/20 0.56
▸ PDE3A Q14432 1/20 0.45
▸ CDK1 P06493 3/20 0.44
▸ CDK2 P24941 2/20 0.44
▸ CCNB1 P14635 1/20 0.44
▸ CCNE1 P24864 1/20 0.44
▸ ADORA2A P29274 7/20 0.43
▸ ADORA1 P30542 6/20 0.43
▸ TMIGD3 P0DMS9 4/20 0.43
▸ ADORA2B P29275 2/20 0.43
▸ HPRT1 P00492 1/20 0.39

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
SCHEMBL9583542 0.86 MEN1 (0.51) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL9583532 0.83 PDE3A (0.47) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL9583855 0.83 MEN1 (0.48) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL9123481 0.83 BLM (0.62) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL9582822 0.82 PDE3A (0.44) BLMMEN1ALDH1A1LMNACYP3A4
Ammonia Solution, Strong SCHEMBL10907047 0.82 BLM (0.60) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL10638325 0.81 LMNA (0.59) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL10818089 0.81 PDE3A (0.41) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL9582915 0.81 MEN1 (0.56) BLMMEN1ALDH1A1LMNACYP3A4
SCHEMBL10904901 0.80 CCNE1 (0.56) BLMMEN1ALDH1A1LMNACYP3A4

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 8 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
EP-0105135-B1 SUBSTITUTED 9-(1-0- OR 3-0-MONOSUBSTITUTED OR 1,3-DI-0-SUBSTITUTED 1,3 DIHYDROXY-2-PROPOXYMETHYL) PURINES AS ANTIVIRAL AGENTS SYNTEX (U.S.A.) INC. (US) 1987-03-18 — — EP 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
US-4609661-A HERPES VIRUS SYNTEX (U.S.A.) INC. (US) 1986-09-02 — — US disclosed
US-4556659-A Substituted 9-(1-0- or 3-0-monosubstituted or 1,3-Di-0-substituted propoxymethyl)-purines as antiviral agents SYNTEX (U.S.A.) INC. (US) 1985-12-03 — — US disclosed
EP-0105135-A1 Substituted 9-(1-0- or 3-0-monosubstituted or 1,3-di-0-substituted 1,3 dihydroxy-2-propoxymethyl) purines as antiviral agents SYNTEX (U.S.A.) INC. (US) 1984-04-11 — — EP 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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