SCHEMBL7832610

SCHEMBL7832610

O=C1C=c2cc(Sc3ncnc4nc[nH]c34)ccc2=N1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 10/20 0.54
DBF4 Q9UBU7 10/20 0.54
G6PD P11413 1/20 0.44
TP53 P04637 2/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 4/20 0.40
CYP3A4 P08684 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GMNN O75496 1/20 0.40
PGR P06401 1/20 0.40
MAPT P10636 1/20 0.40
SLC6A4 P31645 1/20 0.40
BLM P54132 1/20 0.40
HBB P68871 1/20 0.40
PMP22 Q01453 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 3/20 0.39
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 3/20 0.38

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
SCHEMBL8815753 0.81 CDC7 (0.57) CDC7DBF4HSD17B10LMNACYP3A4
SCHEMBL8813155 0.76 NPC1 (0.32) NPC1RAB9ACYP1A2ALDH1A1
SCHEMBL7840014 0.75 PDPK1 (0.43) CDC7DBF4HSD17B10LMNASMN1; SMN2
SCHEMBL7840697 0.73 CDC7 (0.57) CDC7DBF4TP53HSD17B10LMNA
SCHEMBL31060605 0.71 CDC7 (0.73) CDC7DBF4G6PDTP53HSD17B10
SCHEMBL7832613 0.71 CDC7 (0.53) CDC7DBF4G6PDTP53HSD17B10
SCHEMBL796398 0.70 CDC7 (0.72) CDC7DBF4G6PDTP53HSD17B10
SCHEMBL7834057 0.70 CDC7 (0.59) CDC7DBF4G6PDTP53HSD17B10
SCHEMBL27739109 0.68 CDC7 (1.00) CDC7DBF4G6PDTP53HSD17B10
SCHEMBL27488551 0.68 CDC7 (0.55) CDC7DBF4G6PDTP53HSD17B10

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-0802914-B1 ARYL- AND HETEROARYL- PURINE AND PYRIDOPYRIMIDINE DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2001-06-06 EP claimed
EP-0802914-A1 ARYL AND HETEROARYL PURINE COMPOUNDS PHARMACIA & UPJOHN S.p.A. (IT) 1997-10-29 EP claimed
WO-1997018212-A1 ARYL AND HETEROARYL PURINE COMPOUNDS PHARMACIA & UPJOHN S.P.A. (IT) 1997-05-22 WO claimed
EP-0802914-B1 ARYL- AND HETEROARYL- PURINE AND PYRIDOPYRIMIDINE DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2001-06-06 EP disclosed
US-5965563-A NOVEL PURINE DERIVATIVES SUCH AS N6-(2-OXINDOL-5-YL) ADENINE, METHODS OF SYNTHESIZING THEM; USE AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1999-10-12 US disclosed
EP-0802914-A1 ARYL AND HETEROARYL PURINE COMPOUNDS PHARMACIA & UPJOHN S.p.A. (IT) 1997-10-29 EP disclosed
WO-1997018212-A1 ARYL AND HETEROARYL PURINE COMPOUNDS PHARMACIA & UPJOHN S.P.A. (IT) 1997-05-22 WO disclosed