SCHEMBL9395437

SCHEMBL9395437

C=C=C1[C@H](n2c(Cl)nc3c(N)ncnc32)O[C@H](CO)[C@H]1O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSPA8 P11142 5/20 0.49
▸ HSPA5 P11021 3/20 0.49
▸ AHCY P23526 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HBB P68871 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.45
▸ GAPDH P04406 2/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ SLC28A2 O43868 3/20 0.44
▸ ADORA3 P0DMS8 3/20 0.43
▸ ADORA2A P29274 1/20 0.42
▸ ADK P55263 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
SCHEMBL9395442 1.00 HSPA8 (0.49) HSPA8HSPA5AHCYLMNATP53
SCHEMBL9393748 0.89 HSPA8 (0.59) HSPA8HSPA5LMNATP53HBB
SCHEMBL9393756 0.89 HSPA8 (0.59) HSPA8HSPA5LMNATP53HBB
SCHEMBL9393755 0.80 ADORA3 (0.59) AHCYSMN1; SMN2GAPDHSLC28A2ADORA3
SCHEMBL9394617 0.80 ADORA3 (0.59) AHCYSMN1; SMN2GAPDHSLC28A2ADORA3
8-Chloroadenosine SCHEMBL31064773 0.76 HSPA8 (0.78) HSPA8HSPA5LMNATP53HBB
8-Chloroadenosine SCHEMBL987728 0.76 HSPA8 (0.78) HSPA8HSPA5LMNATP53HBB
8-Chloroadenosine SCHEMBL987731 0.76 HSPA8 (0.78) HSPA8HSPA5LMNATP53HBB
8-Chloroadenosine SCHEMBL19680324 0.76 HSPA8 (0.78) HSPA8HSPA5LMNATP53HBB
8-Chloroadenosine SCHEMBL26788558 0.76 HSPA8 (0.78) HSPA8HSPA5LMNATP53HBB

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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