SCHEMBL30739749

SCHEMBL30739749

O=C(Nc1ccccc1)c1c(F)cccc1F

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.71
JAK1 P23458 2/20 0.71
TYK2 P29597 2/20 0.71
HTT P42858 1/20 0.71
NOD2 Q9HC29 1/20 0.71
GAA P10253 1/20 0.69
LMNA P02545 2/20 0.65
RAB9A P51151 5/20 0.61
KMT2A Q03164 9/20 0.61
MEN1 O00255 8/20 0.61
NPC1 O15118 4/20 0.59
TDP1 Q9NUW8 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.54
TP53 P04637 2/20 0.54
POLB P06746 1/20 0.53
KCNK3 O14649 1/20 0.53

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
SCHEMBL28326824 0.93 KMT2A (0.73) JAK2JAK1TYK2HTTNOD2
SCHEMBL16346420 0.88 GAA (0.59) JAK2JAK1TYK2HTTNOD2
SCHEMBL16583943 0.88 GAA (0.59) JAK2JAK1TYK2HTTNOD2
SCHEMBL30739821 0.86 JAK2 (0.69) JAK2JAK1TYK2HTTNOD2
SCHEMBL986128 0.86 RAB9A (0.67) JAK2JAK1TYK2HTTNOD2
SCHEMBL19576334 0.85 GAA (0.56) JAK2JAK1TYK2HTTNOD2
SCHEMBL10198748 0.85 GAA (0.56) JAK2JAK1TYK2HTTNOD2
SCHEMBL1057314 0.83 JAK2 (0.65) JAK2JAK1TYK2HTTNOD2
SCHEMBL678422 0.83 JAK2 (0.65) JAK2JAK1TYK2HTTNOD2
SCHEMBL7927691 0.83 JAK2 (0.65) JAK2JAK1TYK2HTTNOD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118044519-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-05-17 CN disclosed
CN-110072842-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-02-02 CN disclosed