SCHEMBL7075682

SCHEMBL7075682

CC(C)(C)[Si](OC[C@H]1O[C@@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)[C@H](O)[C@@H]1O)(c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 2/20 0.58
P2RY2 P41231 1/20 0.56
P2RY1 P47900 1/20 0.56
P2RY6 Q15077 1/20 0.56
DNPH1 O43598 2/20 0.55
BMPR1B O00238 1/20 0.53
P2RX3 P56373 1/20 0.52
P2RX4 Q99571 1/20 0.52
P2RX2 Q9UBL9 1/20 0.52
ADORA1 P30542 2/20 0.52
NT5E P21589 1/20 0.51
LMNA P02545 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GLA P06280 1/20 0.51
PMP22 Q01453 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPC1 O15118 1/20 0.51
NPY1R P25929 1/20 0.51
HTT P42858 1/20 0.51
NPY2R P49146 1/20 0.51

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
SCHEMBL7075684 1.00 P2RY12 (0.58) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL7065329 0.90 P2RY12 (0.48) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL7065332 0.90 P2RY12 (0.48) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL5511440 0.89 P2RY12 (0.47) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL7251211 0.89 P2RY12 (0.47) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL7251669 0.89 P2RY12 (0.47) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL5507463 0.89 P2RY12 (0.47) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL7063487 0.89 P2RY12 (0.47) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL7063482 0.89 P2RY12 (0.47) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL5507017 0.88 P2RY12 (0.46) P2RY12P2RY2P2RY1P2RY6DNPH1

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
WO-2003059926-A2 METHODS AND COMPOSITIONS FOR AMINOACYL-tRNA SYNTHESIS UNIVERSITY OF MASSACHUSETTS (US) 2003-07-24 WO disclosed