SCHEMBL9393756

SCHEMBL9393756

C=C=C1C(O)[C@@H](CO)O[C@H]1n1c(N)nc2c(N)ncnc21

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSPA8 P11142 4/20 0.59
▸ HSPA5 P11021 2/20 0.59
▸ RXFP1 Q9HBX9 1/20 0.47
▸ GAPDH P04406 2/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ ADORA3 P0DMS8 4/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ HBB P68871 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ ADORA2A P29274 1/20 0.43
▸ SLC28A2 O43868 2/20 0.43

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
SCHEMBL9393748 1.00 HSPA8 (0.59) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9395442 0.89 HSPA8 (0.49) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9395437 0.89 HSPA8 (0.49) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9394617 0.81 ADORA3 (0.59) GAPDHADORA3SMN1; SMN2ADORA2ASLC28A2
SCHEMBL9393755 0.81 ADORA3 (0.59) GAPDHADORA3SMN1; SMN2ADORA2ASLC28A2
SCHEMBL9394656 0.81 HSPA8 (0.60) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9394663 0.81 HSPA8 (0.60) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9394731 0.80 HSPA8 (0.59) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9394722 0.80 HSPA8 (0.59) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL9394744 0.80 HSPA8 (0.59) HSPA8HSPA5RXFP1GAPDHHSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365849-B1 Novel 2'-halomethylidene, 2'-ethenylidene and 2'-ethynyl adenosine derivatives MERRELL DOW PHARMA (US) 1994-09-14 — — EP disclosed
EP-0365849-A2 Novel 2'-halomethylidene, 2'-ethenylidene and 2'-ethynyl adenosine derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1990-05-02 — — EP disclosed
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