SCHEMBL11514820

SCHEMBL11514820

N#C/C=C/Nc1ccnc(-c2ccncc2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
POLB P06746 1/20 0.44
ABCG2 Q9UNQ0 3/20 0.42
LMNA P02545 4/20 0.41
ALDH1A1 P00352 2/20 0.41
ATM Q13315 1/20 0.41
IDE P14735 1/20 0.40
NPC1 O15118 1/20 0.37
MAPK1 P28482 3/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CLK4 Q9HAZ1 6/20 0.34
CYP1A2 P05177 5/20 0.34
CYP3A4 P08684 4/20 0.34
CYP2C19 P33261 4/20 0.34
CYP2D6 P10635 3/20 0.34
ALOX15 P16050 2/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL11514823 1.00 L3MBTL1 (0.46) L3MBTL1RXFP1POLBABCG2LMNA
SCHEMBL11516615 0.78 L3MBTL1 (0.48) L3MBTL1RXFP1POLBABCG2LMNA
SCHEMBL11516598 0.76 POLB (0.51) L3MBTL1RXFP1POLBLMNAALDH1A1
SCHEMBL11516597 0.76 POLB (0.51) L3MBTL1RXFP1POLBLMNAALDH1A1
SCHEMBL11515401 0.75 L3MBTL1 (0.52) L3MBTL1RXFP1POLBLMNAALDH1A1
SCHEMBL11515406 0.75 L3MBTL1 (0.52) L3MBTL1RXFP1POLBLMNAALDH1A1
SCHEMBL11516097 0.72 POLB (0.50) L3MBTL1RXFP1POLBLMNAALDH1A1
SCHEMBL11516091 0.72 POLB (0.50) L3MBTL1RXFP1POLBLMNAALDH1A1
SCHEMBL11515735 0.72 NEK2 (0.51) L3MBTL1RXFP1POLBABCG2LMNA
SCHEMBL11515975 0.72 L3MBTL1 (0.49) L3MBTL1RXFP1POLBABCG2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE30024-E ANTIALLERGENS STERLING DRUG INC. (US) 1979-06-05 US disclosed
US-4118571-A ANTIALLERGENS STERLING DRUG INC. (US) 1978-10-03 US disclosed
US-4086233-A ANTIALLERGENS STERLING DRUG INC. (US) 1978-04-25 US disclosed
US-4032523-A ANTIALLERGENS STERLING DRUG INC. (US) 1977-06-28 US disclosed
US-4018770-A ANTIALLERGENS STERLING DRUG INC. (US) 1977-04-19 US disclosed