SCHEMBL9857536

SCHEMBL9857536

Nc1ncnc2c1ncn2OCCCOCP(=O)(O)O

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 3/20 0.65
▸ SLC22A6 Q4U2R8 2/20 0.65
▸ CYP3A4 P08684 5/20 0.50
▸ ENPP1 P22413 1/20 0.48
▸ CYP2D6 P10635 4/20 0.45
▸ ADCY5 O95622 1/20 0.44
▸ ABCB11 O95342 1/20 0.42
▸ POLA1 P09884 1/20 0.42
▸ POLG P54098 1/20 0.42
▸ FAP Q12884 1/20 0.42
▸ FBP1 P09467 1/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ ADORA1 P30542 1/20 0.42
▸ RNASEL Q05823 3/20 0.42

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
SCHEMBL2107417 0.93 FGFR1 (0.68) FGFR1SLC22A6CYP3A4ENPP1CYP2D6
SCHEMBL29391225 0.93 FGFR1 (0.68) FGFR1SLC22A6CYP3A4ENPP1CYP2D6
SCHEMBL9685282 0.86 FGFR1 (0.53) FGFR1SLC22A6CYP3A4ENPP1CYP2D6
SCHEMBL9185744 0.86 SLC22A6 (0.62) FGFR1SLC22A6CYP3A4ENPP1ABCB11
SCHEMBL6334793 0.86 FGFR1 (0.61) FGFR1SLC22A6CYP3A4ENPP1FBP1
Ammonia Solution, Strong SCHEMBL9124811 0.85 SLC22A6 (0.61) FGFR1SLC22A6CYP3A4ENPP1CYP2D6
Ammonia Solution, Strong SCHEMBL9124830 0.85 SLC22A6 (0.61) FGFR1SLC22A6CYP3A4ENPP1CYP2D6
SCHEMBL9684116 0.85 FGFR1 (0.52) FGFR1SLC22A6CYP3A4ENPP1CYP2D6
SCHEMBL9858167 0.85 FGFR1 (0.49) FGFR1SLC22A6CYP3A4ENPP1
SCHEMBL9858339 0.84 FGFR1 (0.50) FGFR1SLC22A6CYP3A4ENPP1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 — — US claimed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 — — EP claimed
US-5055458-A PURINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BEECHAM GROUP P.L.C. (GB) 1991-10-08 — — US disclosed
EP-0353955-A2 Novel compounds BEECHAM GROUP PLC (GB) 1990-02-07 — — EP disclosed
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