SCHEMBL9685174

SCHEMBL9685174

CO[CH]C1CC([Se]c2ccccc2)C(n2cnc3c(Cl)ncnc32)C1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TYMP P19971 1/20 0.36
AHCY P23526 7/20 0.35

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
SCHEMBL9685176 0.83 TYMP (0.40) TYMPAHCY
SCHEMBL27364364 0.73 TYMP (0.38) TYMPAHCY
SCHEMBL9685297 0.72 YTHDC1 (0.44)
SCHEMBL9686454 0.72 FDPS (0.37) TYMPAHCY
SCHEMBL10171923 0.62 PDE2A (0.42) TYMP
SCHEMBL26382100 0.61 AHCY (0.71) AHCY
SCHEMBL24196376 0.61 ADORA2A (0.65)
SCHEMBL14037522 0.61 AHCY (0.48) AHCY
SCHEMBL130820 0.60 PI4KA (0.43) TYMP
SCHEMBL20691350 0.60 TYMP (0.58) TYMPAHCY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468866-A1 Novel carbocyclic analogs of certain nucleosides MERRELL DOW PHARMACEUTICALS INC. (US) 1992-01-29 EP disclosed
EP-0468119-A1 Novel carbocyclic analogs of certain nucleosides MERRELL DOW PHARMACEUTICALS INC. (US) 1992-01-29 EP disclosed