SCHEMBL30739738

SCHEMBL30739738

NC(=O)[C@H]1[C@H](c2cccc(C(F)(F)F)c2)C1(Cl)Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
KDM1A O60341 1/20 0.40
RCOR1 Q9UKL0 1/20 0.40
HTR2C P28335 3/20 0.40
HTR2A P28223 1/20 0.40
HTR2B P41595 1/20 0.40
GUSB P08236 1/20 0.39
KIF11 P52732 2/20 0.39
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
SLC9A1 P19634 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL18143766 0.87 CES2 (0.42) CES2ALDH1A1LMNAMAPTHTT
SCHEMBL18143768 0.87 CES2 (0.42) CES2ALDH1A1LMNAMAPTHTT
SCHEMBL18157786 0.87 CES2 (0.42) CES2ALDH1A1LMNAMAPTHTT
SCHEMBL30739685 0.81 MEN1 (0.46) CES2ALDH1A1LMNAMAPTHTT
SCHEMBL30739838 0.80 SLC9A1 (0.42) CES2LMNAMAPTSLC9A1
SCHEMBL30739624 0.80 KMT2A (0.35) CES2LMNAMAPTSLC9A1
SCHEMBL20076772 0.80 KDM1A (0.40) ALDH1A1LMNAMAPTHTTKDM1A
SCHEMBL30739839 0.79 SLC9A1 (0.58) ALDH1A1LMNAMAPTHTTHTR3E
SCHEMBL30739932 0.78 SLC9A1 (0.41) ALDH1A1LMNAMAPTHTTSLC9A1
SCHEMBL30961670 0.77 SLC9A1 (0.39) ALDH1A1LMNAMAPTHTTKDM1A

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