SCHEMBL8933938

SCHEMBL8933938

Nc1ncc2ncn(CCOCCO)c2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
ADRA1A P35348 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
HDAC6 Q9UBN7 2/20 0.44
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
USP2 O75604 1/20 0.40
PNP P00491 1/20 0.40
TSHR P16473 1/20 0.40
EDNRA P25101 1/20 0.40
HTR2A P28223 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
HBB P68871 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 4/20 0.37

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
Desciclovir SCHEMBL29403096 0.87 PNP (0.52) HSD17B10KDM4EALDH1A1HPGDADRA1A
Desciclovir SCHEMBL2028 0.87 PNP (0.52) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL3151968 0.85 KDM4E (0.55) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL3852270 0.84 KDM4E (0.50) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL2734857 0.82 FGFR1 (0.58) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL30361311 0.82 FGFR1 (0.58) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL6361387 0.81 KDM4E (0.52) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL2773942 0.81 ALDH1A1 (0.55) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL11001378 0.80 HSD17B10 (0.46) HSD17B10KDM4EALDH1A1HPGDADRA1A
SCHEMBL2734887 0.79 KDM4E (0.51) HSD17B10KDM4EALDH1A1HPGDADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996015779-A1 UNIQUE ASSOCIATED KAPOSI'S SARCOMA VIRUS SEQUENCES AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1996-05-30 WO disclosed