SCHEMBL16986359

SCHEMBL16986359

Nc1nc(N)c2cc(-c3c(Cl)cccc3Cl)c(=O)[nH]c2n1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 2/20 0.41
▸ FGFR1 P11362 6/20 0.40
▸ SRC P12931 6/20 0.40
▸ EGFR P00533 3/20 0.39
▸ KDR P35968 3/20 0.39
▸ GUSB P08236 1/20 0.39
▸ FGFR2 P21802 1/20 0.38
▸ FGFR4 P22455 1/20 0.38
▸ FGFR3 P22607 1/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ TYMS P04818 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ GRIA1 P42261 1/20 0.35
▸ CACNG8 Q8WXS5 1/20 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
SCHEMBL16287646 0.82 NPC1 (0.45) FGFR1SRCEGFRGUSBFGFR2
SCHEMBL5619944 0.78 SRC (0.56) FGFR1SRCEGFRFGFR2FGFR4
SCHEMBL18396162 0.78 FGFR1 (0.46) FGFR1SRCEGFRKDRFGFR2
SCHEMBL16986327 0.78 FGFR1 (0.46) FGFR1SRCEGFRKDR
SCHEMBL16986308 0.76 FGFR1 (0.39) FGFR1SRCEGFRFGFR2FGFR4
SCHEMBL16995184 0.72 FGFR1 (0.67) FGFR1SRCEGFRFGFR2FGFR4
SCHEMBL12235158 0.70 CYP1A2 (0.45) DHFR
SCHEMBL6409360 0.69 CA12 (0.41) DHFREGFRKDRGUSBPDE3B
SCHEMBL16986344 0.69 ADRB2 (0.48) GUSBTP53
SCHEMBL7584087 0.68 GUSB (0.39) FGFR1SRCGUSBPDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015118110-A1 PYRIDO[2,3-D]PYRIMIDINE-7(8H)-ONE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C INSTITUT QUÍMIC DE SARRIÁ, CETS FUNDACIÓ PRIVADA (ES) 2015-08-13 — — WO disclosed
EP-2905024-A1 Pyrido[2,3-d]pyrimidine-7(8H)-one derivatives for the treatment of infections caused by Flaviviridae Institut Quimic De Sarriá Cets, Fundació Privada (ES) 2015-08-12 — — EP disclosed
EP-2905024-A1 Pyrido[2,3-d]pyrimidine-7(8H)-one derivatives for the treatment of infections caused by Flaviviridae Institut Quimic De Sarriá Cets, Fundació Privada (ES) 2015-08-12 — — EP disclosed
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