SCHEMBL9652134

SCHEMBL9652134

Clc1ncnc2c1ncn2COC(COCc1ccccc1)COCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DAPK1 P53355 1/20 0.49
ADORA2A P29274 2/20 0.43
PI4KA P42356 1/20 0.43
PI4K2B Q8TCG2 1/20 0.43
PI4K2A Q9BTU6 1/20 0.43
PI4KB Q9UBF8 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
FDPS P14324 1/20 0.41
CYP1A2 P05177 2/20 0.41
FGFR1 P11362 2/20 0.40
FGFR4 P22455 2/20 0.40
P2RX7 Q99572 1/20 0.40
HPGD P15428 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
AGER Q15109 1/20 0.39

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
SCHEMBL4096596 0.86 ADORA2A (0.58) DAPK1ADORA2API4KAPI4K2BPI4K2A
SCHEMBL10496728 0.82 DAPK1 (0.49) DAPK1ADORA2API4KAPI4K2BPI4K2A
SCHEMBL9592643 0.80 FGFR1 (0.40) DAPK1HDAC6FDPSFGFR1FGFR4
SCHEMBL10579865 0.79 DAPK1 (0.46) DAPK1ADORA2ACYP1A2CYP3A4CYP2D6
SCHEMBL30984022 0.76 ADORA2A (0.70) DAPK1ADORA2API4KAPI4K2BPI4K2A
SCHEMBL2980291 0.76 ADORA2A (0.70) DAPK1ADORA2API4KAPI4K2BPI4K2A
SCHEMBL4094994 0.76 ADORA2A (0.56) DAPK1ADORA2API4KAPI4K2BPI4K2A
SCHEMBL9575530 0.74 ACHE (0.43) ADORA2AHDAC6
SCHEMBL5459069 0.74 DAPK1 (0.67) DAPK1ADORA2API4KAPI4K2BPI4K2A
SCHEMBL9417129 0.73 DAPK1 (0.33) DAPK1HDAC6FDPSFGFR1FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5157120-A Guanine derivatives SYNTEX (U.S.A.) INC. (US) 1992-10-20 US disclosed
US-4868187-A Anti-viral N-substituted pyrimidines SYNTEX (U.S.A.) INC. (US) 1989-09-19 US disclosed
EP-0260596-A2 2-Amino-6-alkoxy-purins substituted in position 9, process for their preparation, their use and pharmaceutical compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1988-03-23 EP disclosed
US-4347360-A Ring open nucleoside analogues ENS BIO LOGICALS INC. (CA) 1982-08-31 US disclosed
EP-0049072-A1 Guanine compounds and their use for the preparation of anti-viral agents SYNTEX (U.S.A.) INC. (US) 1982-04-07 EP disclosed