SCHEMBL7897993

SCHEMBL7897993

Nc1nc(C(=O)c2ccccc2)nc2c1ncn2C1O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.67
ADORA3 P0DMS8 6/20 0.67
ADORA1 P30542 4/20 0.67
ADORA2B P29275 3/20 0.66
CYP1A2 P05177 2/20 0.66
THPO P40225 1/20 0.66
MEN1 O00255 1/20 0.66
CYP2D6 P10635 1/20 0.66
CYP2C9 P11712 1/20 0.66
CYP2C19 P33261 1/20 0.66
KMT2A Q03164 1/20 0.66
BLM P54132 1/20 0.66
LMNA P02545 1/20 0.63
NT5E P21589 1/20 0.63
HIF1A Q16665 1/20 0.63

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
SCHEMBL5794230 1.00 ADORA2A (0.67) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL2343062 1.00 ADORA2A (0.67) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL7525475 0.99 ADORA2A (0.66) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL5066869 0.89 ADORA2A (0.55) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL5621712 0.84 P2RX3 (0.55) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL31490481 0.82 ADORA2A (0.69) ADORA2AADORA3ADORA1ADORA2BLMNA
Adenosine SCHEMBL11656001 0.81 ADORA3 (0.78) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL2345593 0.81 ADORA2A (0.51) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL11876222 0.80 ADORA3 (0.77) ADORA2AADORA3ADORA1ADORA2BCYP1A2
SCHEMBL11876247 0.80 ADORA3 (0.77) ADORA2AADORA3ADORA1ADORA2BCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187585-B1 NUCLEOTIDE SEQUENCE COMPLEMENTARY TO 5' UNTRANSLATED REGION OR CODING REGION OF NUCLEIC ACID WHICH CODES FOR RECEPTOR; ANTITUMOR/ANTICARCINOGENIC/ANTIPROLIFERATIVE AGENTS ISIS PHARMACEUTICALS, INC. 2001-02-13 US disclosed
EP-0604409-A4 COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION. ISIS PHARMACEUTICALS INC (US) 1996-06-12 EP disclosed
EP-0604409-A1 COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 1994-07-06 EP disclosed
WO-1991010671-A1 COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION ISIS PHARMACEUTICALS, INC. (US) 1991-07-25 WO disclosed