SCHEMBL1719973

SCHEMBL1719973

Cc1cccc(NC(=O)N2CCN(c3nc(N)nc4oc(CCc5ccc(F)cc5)nc34)CC2)c1.Nc1nc(N2CCN(CCOc3ccccc3)CC2)c2nc(CCc3ccc(F)cc3)oc2n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 4/20 0.49
KDM4E B2RXH2 1/20 0.44
FAAH O00519 8/20 0.42
LIMK2 P53671 2/20 0.41
KCNH2 Q12809 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NLRP3 Q96P20 1/20 0.40
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
P2RY12 Q9H244 2/20 0.39
KIT P10721 1/20 0.38

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
SCHEMBL655534 0.90 PI4KB (0.57) PI4KBKDM4EFAAHLIMK2KCNH2
SCHEMBL655138 0.85 LTA4H (0.42) KCNH2MAPT
SCHEMBL1694426 0.81 PI4KB (0.47) PI4KBKDM4EFAAHLIMK2SMN1; SMN2
SCHEMBL654888 0.75 PI4KB (0.62) PI4KBFAAHLIMK2KCNH2SMN1; SMN2
SCHEMBL654034 0.73 DRD4 (0.43) PI4KBKDM4EKCNH2SMN1; SMN2MAPT
SCHEMBL654035 0.73 MEN1 (0.44) PI4KBSMN1; SMN2
SCHEMBL654810 0.72 PI4KB (0.57) PI4KBKCNH2MAPTRAB9A
SCHEMBL652076 0.71 PI4KB (0.63) PI4KBFAAHLIMK2KCNH2SMN1; SMN2
SCHEMBL4528644 0.71 PI4KB (0.62) PI4KBFAAHLIMK2KCNH2MAPT
SCHEMBL655003 0.70 PI4KB (0.66) PI4KBFAAHLIMK2KCNH2MAPT

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-2405973-A2 THIAZOLOPYRIMIDINE MODULATORS AS IMMUNOSUPPRESSIVE AGENTS Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) 2012-01-18 EP disclosed