SCHEMBL28064969

SCHEMBL28064969

Cc1cccn1-c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.47
PTGS1 P23219 1/20 0.44
NOTUM Q6P988 2/20 0.41
ACHE P22303 1/20 0.40
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
MGLL Q99685 1/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL18885212 0.84 RECQL (0.46) PTGS2NOTUMACHEALDH1A1KDM4E
SCHEMBL1127502 0.81 ATM (0.48) NOTUMACHEALDH1A1KDM4EHPGD
SCHEMBL2615405 0.81 TDP1 (0.40) PTGS2KCNH2ALDH1A1
SCHEMBL7802726 0.80 FAAH (0.34) PTGS2ALDH1A1HPGDMGLL
SCHEMBL5272522 0.80 BIRC5 (0.46) NOTUMALDH1A1KDM4EHPGDNPC1
SCHEMBL12270200 0.78 KDM4E (0.32) ALDH1A1KDM4E
SCHEMBL14018033 0.78 PTGS2 (0.45) PTGS2PTGS1ALDH1A1KDM4ETP53
SCHEMBL8137135 0.77 KEAP1 (0.49) NOTUMACHEALDH1A1MGLL
SCHEMBL9799509 0.76 ATM (0.31) ALDH1A1
SCHEMBL23245708 0.75 PKM (0.48) ALDH1A1KDM4ETP53

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
CN-103416106-B The manufacture method of light-emitting component, luminescent device and light-emitting component SEMICONDUCTOR ENERGY LABORATORY CO.,LTD. (JP) 2016-05-18 CN disclosed