SCHEMBL30739873

SCHEMBL30739873

N#Cc1cc(F)ccc1N(Cc1ccccc1)C(=O)c1cc(N)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 1/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PDK1 Q15118 5/20 0.35
TDP1 Q9NUW8 1/20 0.34
POLB P06746 2/20 0.34
ATF1 P18846 1/20 0.33
NFKB1 P19838 1/20 0.33

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
SCHEMBL20045598 1.00 GPBAR1 (0.37) GPBAR1MEN1KMT2AGAASMN1; SMN2
SCHEMBL20045600 0.85 GPBAR1 (0.37) GPBAR1MEN1KMT2AGAAPOLB
SCHEMBL20901186 0.85 GPBAR1 (0.37) GPBAR1
SCHEMBL30739664 0.85 CTSB (0.46) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL20051592 0.85 CTSB (0.46) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL30739658 0.84 GPBAR1 (0.36) GPBAR1
SCHEMBL20045596 0.84 GPBAR1 (0.36) GPBAR1
SCHEMBL30739630 0.83 GPBAR1 (0.36) GPBAR1SMN1; SMN2
SCHEMBL20045595 0.83 GPBAR1 (0.36) GPBAR1SMN1; SMN2
SCHEMBL20045597 0.81 GPBAR1 (0.37) GPBAR1POLB

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