SCHEMBL19146448

SCHEMBL19146448

NC[C@@H]1CC[C@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)O1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
ABL1 P00519 4/20 0.46
RIN1 Q13671 4/20 0.46
PRMT6 Q96LA8 1/20 0.46
NR2F2 P24468 2/20 0.44
GALR3 O60755 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
P2RY12 Q9H244 2/20 0.43

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
SCHEMBL19343832 0.91 ABL1 (0.56) CYP1A2ABL1RIN1NR2F2GALR3
SCHEMBL25004 0.91 ABL1 (0.56) CYP1A2ABL1RIN1NR2F2GALR3
SCHEMBL13965624 0.89 PRMT6 (0.44) ABL1RIN1PRMT6P2RY12
SCHEMBL19146385 0.88 CYP1A2 (0.44) CYP1A2ABL1RIN1PRMT6NR2F2
SCHEMBL19146239 0.88 P2RY12 (0.44) CYP1A2ABL1RIN1PRMT6NR2F2
SCHEMBL12652414 0.87 UBA6 (0.47) CYP1A2ABL1RIN1PRMT6NR2F2
SCHEMBL21540034 0.87 P2RY12 (0.44) CYP1A2ABL1RIN1PRMT6NR2F2
SCHEMBL21726069 0.86 P2RY12 (0.55) P2RY12
SCHEMBL22907485 0.86 CYP1A2 (0.43) CYP1A2ABL1RIN1PRMT6NR2F2
SCHEMBL20792252 0.85 ADORA3 (0.44) PRMT6NPC1RAB9ASMN1; SMN2P2RY12

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-2017123669-A1 CYCLIC DINUCLEOTIDES FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY SUCH AS CANCER GLICK GARY (US) 2017-07-20 WO disclosed