SCHEMBL29953666

SCHEMBL29953666

OB(O)c1cnc(NCCCN2CCOCC2)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 2/20 0.50
MERTK Q12866 2/20 0.50
GAS6 Q14393 2/20 0.50
KDM4E B2RXH2 4/20 0.45
GAA P10253 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.45
POLB P06746 1/20 0.45
RAD52 P43351 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CDK4 P11802 1/20 0.44
GSK3B P49841 1/20 0.44
HPGD P15428 1/20 0.43
DUSP3 P51452 1/20 0.43
FGFR1 P11362 1/20 0.43
SRC P12931 1/20 0.43
FGFR2 P21802 1/20 0.43

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
SCHEMBL3577968 0.82 EGFR (0.52) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL2943473 0.82 TYRO3 (0.50) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL14454203 0.80 TYRO3 (0.51) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL28372825 0.79 KDM4E (0.54) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL11988204 0.78 TYRO3 (0.50) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL951715 0.77 KDM4E (0.49) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL2948725 0.76 MAPT (0.59) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL19425648 0.75 KDM4E (0.45) TYRO3MERTKGAS6KDM4EGAA
SCHEMBL3323149 0.75 FYN (0.49) KDM4ENPC1RAB9ALMNANPSR1
SCHEMBL247578 0.73 KCNH3 (0.39) TYRO3MERTKGAS6POLBRAD52

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed