SCHEMBL9583770

SCHEMBL9583770

CSc1nc(N(C)C)nc2c1ncn2C(OCCCOC(=O)C(C)(C)C)OC(=O)C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL10815169 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL10816122 0.81 — —
SCHEMBL9584895 0.79 HK1 (0.41) ALDH1A1
SCHEMBL9583904 0.79 CYP1A2 (0.39) —
SCHEMBL9583081 0.78 CDK1 (0.44) —
SCHEMBL9584953 0.75 CDC20 (0.35) —
SCHEMBL9583774 0.74 PDE3A (0.38) ALDH1A1
SCHEMBL10540197 0.74 CDK2 (0.36) —
SCHEMBL10364403 0.73 ACHE (0.38) —
SCHEMBL9594480 0.72 HK1 (0.43) ALDH1A1

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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