SCHEMBL4722932

SCHEMBL4722932

Cc1c[nH]c2[nH]c(N)nc(=O)c12

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.36
CYP1A2 P05177 1/20 0.36
TYMS P04818 6/20 0.36
ATAD2 Q6PL18 1/20 0.34
FABP6 P51161 1/20 0.34
PNP P00491 2/20 0.33
CYP3A4 P08684 1/20 0.33
BLM P54132 1/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33

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
SCHEMBL20202023 0.79 BACE1 (0.36) TYMSPNP
SCHEMBL24629142 0.79 TYMS (0.38) TYMSPNPCYP3A4BLM
SCHEMBL28919394 0.79 FGFR1 (0.36) XDHTYMSPNPCYP3A4BLM
SCHEMBL25899172 0.78 L3MBTL1 (0.32) PNPCYP3A4BLM
SCHEMBL25899106 0.78 CHEK1 (0.35) TYMSPNPCYP3A4BLMFGFR1
SCHEMBL20206657 0.76 PNP (0.35) PNP
SCHEMBL20202010 0.76 PNP (0.36) PNP
SCHEMBL20202013 0.73 PNP (0.39) PNP
SCHEMBL10119987 0.72
SCHEMBL20206756 0.72 PNP (0.39) TYMSPNP

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
WO-2022272307-A1 BIFUNCTIONAL FOLATE RECEPTOR BINDING COMPOUNDS LYCIA THERAPEUTICS, INC. (US) 2022-12-29 WO disclosed
WO-2022150721-A1 BIFUNCTIONAL FOLATE RECEPTOR BINDING COMPOUNDS LYCIA THERAPEUTICS, INC. (US) 2022-07-14 WO disclosed
EP-1948659-A1 PYRROLOPYRIMIDINE DERIVATIVES AS SYK INHIBITORS GLAXO GROUP LIMITED (GB) 2008-07-30 EP disclosed
WO-2007042299-A1 PYRROLOPYRIMIDINE DERIVATIVES AS SYK INHIBITORS GLAXO GROUP LIMITED (GB) 2007-04-19 WO disclosed