SCHEMBL11640373

SCHEMBL11640373

Cc1ccccc1S(=O)(=O)n1c(C(F)F)nc2c([N+](=O)[O-])cc(C(F)(F)F)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.38
▸ MAPK1 P28482 3/20 0.38
▸ NFKBIA P25963 2/20 0.38
▸ RELA Q04206 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ POLB P06746 1/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ RECQL P46063 1/20 0.35
▸ SLC40A1 Q9NP59 1/20 0.35
▸ GAA P10253 2/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34

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
SCHEMBL8855562 0.73 LMNA (0.49) LMNAMAPK1NFKBIARELATDP1
SCHEMBL8855618 0.73 LMNA (0.54) LMNAMAPK1NFKBIARELATDP1
SCHEMBL11863391 0.70 ALDH1A1 (0.42) LMNAMAPK1NFKBIARELATDP1
SCHEMBL8947516 0.68 CYP3A4 (0.40) LMNAMAPK1NFKBIARELATDP1
SCHEMBL11645840 0.67 LMNA (0.42) LMNAMAPK1NFKBIARELATDP1
SCHEMBL8947549 0.66 CYP3A4 (0.43) LMNAMAPK1TDP1POLBKMT2A
SCHEMBL11644265 0.66 MAPK1 (0.41) LMNAMAPK1TDP1KMT2ASMN1; SMN2
SCHEMBL11642421 0.64 ALDH1A1 (0.50) MAPK1TDP1POLBSMN1; SMN2GAA
SCHEMBL8947515 0.64 MAPK1 (0.48) LMNAMAPK1TDP1KMT2AGAA
SCHEMBL8855540 0.64 PLK1 (0.43) LMNAMAPK1TDP1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4122184-A Benzimidazole insecticides ELI LILLY AND COMPANY (US) 1978-10-24 — — US disclosed
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