SCHEMBL16349580

SCHEMBL16349580

N#Cc1ncn([C@@H]2OC[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 11/20 0.42
▸ PTPN1 P18031 1/20 0.35
▸ SLC18A3 Q16572 1/20 0.34

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
SCHEMBL16349579 0.82 KMT2A (0.38) PTPN1
SCHEMBL12150465 0.80 PTPN1 (0.41) PTPN1
SCHEMBL12150506 0.80 KMT2A (0.37) BCHE
SCHEMBL13633941 0.80 PTPN1 (0.41) PTPN1
SCHEMBL13530678 0.78 POLB (0.44) —
SCHEMBL12150509 0.78 POLB (0.44) —
SCHEMBL12300354 0.75 CA1 (0.42) PTPN1
SCHEMBL12746702 0.73 CA1 (0.37) PTPN1
SCHEMBL14071885 0.73 CA1 (0.36) PTPN1
SCHEMBL12150462 0.72 CA1 (0.33) —

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-7429565-B2 Antiviral phosphonate analogs GILEAD SCIENCES, INC. (US) 2008-09-30 — — US disclosed
Send feedback