SCHEMBL9686502

SCHEMBL9686502

CCC(C)OP(=O)(O)COC1CCC(n2cnc3c(Cl)ncnc32)C1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADCY5 O95622 11/20 0.46
FDPS P14324 1/20 0.38
DGAT1 O75907 1/20 0.35
P2RY1 P47900 1/20 0.35
YTHDC1 Q96MU7 1/20 0.34

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
SCHEMBL9685083 0.85 ADCY5 (0.54) ADCY5FDPSDGAT1P2RY1
SCHEMBL9686498 0.82 ADCY5 (0.49) ADCY5FDPSDGAT1P2RY1YTHDC1
SCHEMBL9684255 0.73 ADCY5 (0.72) ADCY5
SCHEMBL9685322 0.72 YTHDC1 (0.60) ADCY5P2RY1YTHDC1
SCHEMBL27352027 0.72 ADCY5 (0.37) ADCY5FDPSDGAT1P2RY1YTHDC1
SCHEMBL9686090 0.71 ADCY5 (0.47) ADCY5FDPSDGAT1P2RY1
SCHEMBL9685206 0.71 FDPS (0.43) ADCY5FDPSDGAT1P2RY1YTHDC1
SCHEMBL8660803 0.71 ADCY5 (0.65) ADCY5
SCHEMBL24196376 0.68 ADORA2A (0.65) ADCY5YTHDC1
SCHEMBL10475247 0.68 ADCY5 (0.55) ADCY5DGAT1YTHDC1

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
EP-0468119-A1 Novel carbocyclic analogs of certain nucleosides MERRELL DOW PHARMACEUTICALS INC. (US) 1992-01-29 EP disclosed