SCHEMBL7812404

SCHEMBL7812404

O=c1nc[nH]c2ncn(Cc3ccccc3)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARN O95453 1/20 0.54
CNOT7 Q9UIV1 1/20 0.54
ACP1 P24666 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
ADORA2B P29275 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
PNP P00491 2/20 0.45
ALDH1A1 P00352 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
MAPT P10636 1/20 0.44
PDE4A P27815 1/20 0.43
TNF P01375 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
POLB P06746 1/20 0.42
HIF1A Q16665 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
HPGD P15428 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
SCHEMBL7977499 0.92 CYP11B1 (0.48) PARNCNOT7ACP1SMN1; SMN2ADORA2B
SCHEMBL7120147 0.84 DAO (0.40) PARNCNOT7SMN1; SMN2ALDH1A1HIF1A
SCHEMBL7117262 0.81 LMNA (0.60)
SCHEMBL30947391 0.79 PARN (0.51) PARNCNOT7ACP1SMN1; SMN2ADORA2B
SCHEMBL3306016 0.77 PNP (0.48) PARNCNOT7ACP1PNPALDH1A1
SCHEMBL2958439 0.77 SMN1; SMN2 (0.53) PARNCNOT7ACP1SMN1; SMN2ADORA2B
SCHEMBL30804827 0.76 ADORA2A (0.40) ADORA2BPDE4A
SCHEMBL7974027 0.76 CNOT7 (0.57) PARNCNOT7SMN1; SMN2ADORA2BRXFP1
SCHEMBL1713107 0.76 PNP (0.61) PARNCNOT7SMN1; SMN2ADORA2BRXFP1
SCHEMBL7975271 0.75 CNOT7 (0.56) PARNCNOT7SMN1; SMN2ADORA2BRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0728757-B1 Process for producing purine derivatives AJINOMOTO KK (JP) 2001-10-04 EP disclosed
US-6245910-B1 Process for producing purine derivatives AJINOMOTO CO., INC. (JP) 2001-06-12 US disclosed
US-6087497-A DEBENZYLATION OF PURINE TO FORM VIRICIDES AJINOMOTO CO., INC. (JP) 2000-07-11 US disclosed
US-5942617-A Process for producing purine derivatives AJINOMOTO CO., INC. (JP) 1999-08-24 US disclosed
US-5831092-A Process for producing purine derivatives AJINOMOTO CO., INC. (JP) 1998-11-03 US disclosed
EP-0827960-A1 Process for producing purine derivatives Ajinomoto Co., Inc. (JP) 1998-03-11 EP disclosed
EP-0728757-A1 Process for producing purine derivatives Ajinomoto Co., Inc. (JP) 1996-08-28 EP disclosed