SCHEMBL9548723

SCHEMBL9548723

CC(C)(C)[Si](C)(C)O[C@H]1C[C@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@]1(C=O)CO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.45
POLB P06746 1/20 0.42
HPRT1 P00492 2/20 0.39
HPGD P15428 1/20 0.39
HINT1 P49773 1/20 0.39
BLM P54132 2/20 0.38
USP2 O75604 1/20 0.38
PNP P00491 1/20 0.38
TSHR P16473 1/20 0.38
EDNRA P25101 1/20 0.38
HTR2A P28223 1/20 0.38
RECQL P46063 1/20 0.38
HBB P68871 1/20 0.38
HSD17B10 Q99714 1/20 0.38
STING1 Q86WV6 1/20 0.38
TK1 P04183 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 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
SCHEMBL9548736 1.00 ADORA3 (0.45) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548660 0.92 ADORA3 (0.43) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548649 0.92 ADORA3 (0.43) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548596 0.88 ADORA3 (0.47) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548741 0.88 ADORA3 (0.47) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548601 0.88 ADORA3 (0.47) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548756 0.88 ADORA3 (0.47) ADORA3POLBHPRT1HPGDHINT1
SCHEMBL9548631 0.87 ALDH1A1 (0.46) ADORA3HPRT1PNPSTING1ALDH1A1
SCHEMBL9548788 0.86 AHCY (0.41) ADORA3HINT1PNPHBBLMNA
SCHEMBL9548842 0.85 ADORA3 (0.45) ADORA3POLBHPRT1HPGDHINT1

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
US-5192749-A Viricide, AIDS SYNTEX (U.S.A.) INC. (US) 1993-03-09 US disclosed