SCHEMBL9850183

SCHEMBL9850183

O=C(Nc1ncnc2c1ncn2[C@H]1C[C@H](OC(=O)c2ccccc2)[C@@H](COC(=O)c2ccccc2)O1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
P2RY12 Q9H244 5/20 0.45
LMNA P02545 1/20 0.45
PRMT6 Q96LA8 1/20 0.43
P2RY1 P47900 2/20 0.43
P2RX3 P56373 1/20 0.43
P2RX4 Q99571 1/20 0.43
P2RX2 Q9UBL9 1/20 0.43
P2RY2 P41231 1/20 0.43
P2RY6 Q15077 1/20 0.43
DNPH1 O43598 1/20 0.42

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
SCHEMBL15143709 0.92 POLB (0.61) POLB
SCHEMBL12362206 0.92 POLB (0.61) POLB
SCHEMBL11683614 0.92 POLB (0.61) POLB
SCHEMBL19519648 0.92 POLB (0.61) POLB
SCHEMBL9650579 0.90 P2RY12 (0.50) POLBP2RY12LMNAP2RY1P2RY2
SCHEMBL9651474 0.90 P2RY12 (0.50) POLBP2RY12LMNAP2RY1P2RY2
SCHEMBL9650582 0.90 P2RY12 (0.50) POLBP2RY12LMNAP2RY1P2RY2
SCHEMBL9603811 0.89 PRMT6 (0.49) POLBP2RY12PRMT6P2RY1P2RY2
SCHEMBL7519318 0.89 P2RY12 (0.46) P2RY12LMNAPRMT6P2RY1P2RX3
SCHEMBL21577255 0.86 POLB (0.44) POLBP2RY12PRMT6P2RY1P2RX3

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
EP-0428109-A2 Deoxyfluoronucleoside process Bristol-Myers Squibb Company (US) 1991-05-22 EP disclosed