SCHEMBL10336097

SCHEMBL10336097

COc1ncnc2c1ncn2-n1cnc2c(C)ncnc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT4 P35916 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ HPGD P15428 1/20 0.39
▸ TAAR1 Q96RJ0 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.34
▸ PI4KA P42356 2/20 0.33
▸ PI4K2B Q8TCG2 2/20 0.33
▸ PI4K2A Q9BTU6 2/20 0.33
▸ PI4KB Q9UBF8 2/20 0.33
▸ DAPK1 P53355 1/20 0.33
▸ ADORA2A P29274 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ PDPK1 O15530 1/20 0.31
▸ NSD3 Q9BZ95 1/20 0.31
▸ YTHDC1 Q96MU7 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
SCHEMBL4379586 0.75 ADORA1 (0.56) FLT4KDRHPGDTAAR1ALDH1A1
SCHEMBL5699095 0.74 FLT4 (0.46) FLT4KDRHPGDTAAR1ALDH1A1
SCHEMBL19987154 0.74 FLT4 (0.46) FLT4KDRHPGDTAAR1ALDH1A1
SCHEMBL9503851 0.74 FLT4 (0.49) FLT4KDRHPGDTAAR1ALDH1A1
SCHEMBL731404 0.72 CYP2C9 (0.36) ALDH1A1ADORA2AADORA1MEN1KMT2A
SCHEMBL12194499 0.71 PI4KA (0.60) FLT4KDRHPGDTAAR1ALDH1A1
SCHEMBL6364118 0.71 ADORA2A (0.60) FLT4KDRTAAR1PI4KAPI4K2B
SCHEMBL17364335 0.71 ADORA2A (0.60) FLT4KDRHPGDTAAR1PI4KA
SCHEMBL24205301 0.70 FLT4 (0.43) FLT4KDRHPGDTAAR1ALDH1A1
SCHEMBL22326753 0.70 ADORA2A (0.46) FLT4KDRHPGDTAAR1PI4KA

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-0365556-A1 NUCLEOSIDE ANALOGUES. GENENTECH INC (US) 1990-05-02 — — EP claimed
WO-1988009796-A1 NUCLEOSIDE ANALOGUES GENENTECH, INC. (US) 1988-12-15 — — WO claimed
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