SCHEMBL22004578

SCHEMBL22004578

Nc1ncc2c(ncn2N)n1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ FGFR1 P11362 2/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.31
▸ HRH4 Q9H3N8 1/20 0.30

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
SCHEMBL24077180 0.78 HRH4 (0.40) ALDH1A1FGFR1HRH4
SCHEMBL27658628 0.71 ADORA2A (0.41) ALDH1A1RXFP1
SCHEMBL7815689 0.68 CYP11B1 (0.51) ALDH1A1HRH4
SCHEMBL27303515 0.67 HDAC6 (0.40) ALDH1A1RXFP1HRH4
SCHEMBL23422251 0.64 ALDH1A1 (0.36) ALDH1A1RXFP1
SCHEMBL17040215 0.62 — —
SCHEMBL10653924 0.62 KMT2A (0.44) ALDH1A1RXFP1
SCHEMBL16302870 0.61 MET (0.46) ALDH1A1FGFR1HRH4
SCHEMBL16302871 0.61 NOS3 (0.38) HRH4
SCHEMBL30112896 0.58 CLK1 (0.43) ALDH1A1HRH4

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-3282015-B1 METHOD FOR CELLULAR RNA EXPRESSION BIONTECH RNA PHARMACEUTICALS GMBH (DE) 2020-05-20 — — EP disclosed
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