SCHEMBL30739670

SCHEMBL30739670

NC(=O)[C@H]1[C@H](c2cc(Cl)c(Cl)c(Cl)c2)C1(Cl)Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.39
KMT2A Q03164 6/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 2/20 0.35
HTR3E A5X5Y0 2/20 0.33
HTR3B O95264 2/20 0.33
HTR3A P46098 2/20 0.33
HTR3D Q70Z44 2/20 0.33
HTR3C Q8WXA8 2/20 0.33
MEN1 O00255 5/20 0.33
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
LMNA P02545 3/20 0.31
HTT P42858 3/20 0.31
HPGD P15428 2/20 0.31
MAPK1 P28482 1/20 0.31
CYP3A4 P08684 2/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL30739906 0.89 SLC9A1 (0.35) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL30739754 0.86 SLC9A1 (0.37) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL30739637 0.85 SLC9A1 (0.33) SLC9A1KMT2AMAPTHTR3EHTR3B
SCHEMBL18143828 0.84 ALDH1A1 (0.38) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL21019043 0.84 ALDH1A1 (0.38) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL18143602 0.84 ALDH1A1 (0.38) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL20845988 0.84 ALDH1A1 (0.38) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL18163166 0.84 SLC9A1 (0.54) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL18143907 0.84 ALDH1A1 (0.38) SLC9A1KMT2AMAPTNPSR1MEN1
SCHEMBL29243271 0.84 MEN1 (0.33) SLC9A1KMT2AMAPTNPSR1MEN1

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