SCHEMBL29543109

SCHEMBL29543109

CCS(=O)(=O)c1ccc(-n2cncn2)nc1-c1nc2cc(S(=N)(=O)C(F)(F)F)ccc2o1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UTRN P46939 3/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ AHR P35869 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ MAOB P27338 1/20 0.35
▸ SLC47A1 Q96FL8 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ LMNA P02545 2/20 0.32
▸ GLA P06280 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 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
SCHEMBL27141980 1.00 UTRN (0.38) UTRNCYP1A2AHRHDAC6MAOB
SCHEMBL17382837 0.91 UTRN (0.39) UTRNCYP1A2AHRHDAC6MAOB
SCHEMBL29543107 0.88 UTRN (0.36) UTRNCYP1A2AHRHDAC6MAOB
SCHEMBL17382621 0.86 UTRN (0.36) UTRNCYP1A2AHRHDAC6MEN1
SCHEMBL17382623 0.84 UTRN (0.35) UTRNCYP1A2AHRHDAC6MAOB
SCHEMBL17383124 0.84 CYP1A2 (0.32) UTRNCYP1A2AHRHDAC6
SCHEMBL29543391 0.81 LMNA (0.35) LMNAALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL27145437 0.81 LMNA (0.35) LMNAALDH1A1SMN1; SMN2HTTNPC1
SCHEMBL29543118 0.77 UTRN (0.45) UTRNCYP1A2AHRHDAC6MAOB
SCHEMBL27151992 0.77 UTRN (0.45) UTRNCYP1A2AHRHDAC6MAOB

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-114450280-B Pesticidally active heterocyclic derivatives with sulfur and sulfoximine substituents 先正达农作物保护股份公司 2025-02-25 — — CN claimed
CN-114450280-A Pesticidally active heterocyclic derivatives with sulphur-and sulphoxide imine substituents 先正达农作物保护股份公司 2022-05-06 — — CN claimed
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