SCHEMBL7905972

SCHEMBL7905972

CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(Cl)nc(C)nc21

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
TP53 P04637 2/20 0.61
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ADORA2A P29274 6/20 0.51
ADORA2B P29275 2/20 0.51
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
HPGD P15428 1/20 0.49
ADORA3 P0DMS8 5/20 0.48
ADORA1 P30542 4/20 0.48
PDE2A O00408 1/20 0.48
ADRA1A P35348 1/20 0.48
PDE4D Q08499 1/20 0.48
PDE3A Q14432 1/20 0.48
CYP2C19 P33261 1/20 0.47

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
SCHEMBL6364030 0.88 LMNA (0.60) LMNATP53MEN1KMT2AADORA2A
SCHEMBL741775 0.88 LMNA (0.78) LMNATP53ADORA2AADORA2BHPGD
SCHEMBL741776 0.88 LMNA (0.78) LMNATP53ADORA2AADORA2BHPGD
SCHEMBL8626875 0.87 ADORA2A (0.64) LMNAADORA2AADORA2BADORA3ADORA1
SCHEMBL26646355 0.87 ADORA2A (0.64) LMNAADORA2AADORA2BADORA3ADORA1
SCHEMBL9413285 0.85 ADORA3 (0.62) MEN1KMT2AADORA2AADORA2BADORA3
SCHEMBL6635214 0.85 MEN1 (0.65) LMNATP53MEN1KMT2AADORA2A
SCHEMBL20724423 0.85 PDE2A (0.67) LMNATP53ADORA2AADORA2BHPGD
SCHEMBL1796936 0.85 MEN1 (0.65) LMNATP53MEN1KMT2AADORA2A
SCHEMBL8904692 0.83 LMNA (0.61) LMNATP53MEN1KMT2AADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE37077-E1 Adenosine derivatives and pharmaceutical composition thereof NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
EP-0378518-B1 Adenosine derivatives having pharmaceutical activity as antihypertensives NIPPON ZOKI PHARMACEUTICAL CO (JP) 1994-09-28 EP disclosed
US-4985409-A HYPOTENSIVE AGENTS NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1991-01-15 US disclosed