SCHEMBL9550751

SCHEMBL9550751

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

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYMP P19971 10/20 0.69
P2RY12 Q9H244 2/20 0.62
P2RY2 P41231 1/20 0.58
P2RY1 P47900 1/20 0.58
P2RY6 Q15077 1/20 0.58
DNPH1 O43598 2/20 0.58
ADORA1 P30542 2/20 0.58

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
SCHEMBL9024707 1.00 TYMP (0.69) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL19485497 0.96 TYMP (0.64) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL17301045 0.96 TYMP (0.64) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL17304362 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL19493362 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL917680 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL8386141 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL19493363 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL29679722 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6
SCHEMBL917678 0.94 TYMP (0.67) TYMPP2RY12P2RY2P2RY1P2RY6

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-0558749-A1 ANTISENSE NUCLEIC ACID DERIVATIVE SANKYO COMPANY LIMITED (JP) 1993-09-08 EP disclosed