SCHEMBL9840179

SCHEMBL9840179

[CH2]c1ccc(SC(F)(F)F)nc1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL15388393 0.75 KDM4E (0.48) KDM4EALDH1A1TDP1
SCHEMBL18194085 0.75 CCR1 (0.43) KDM4EALDH1A1
SCHEMBL5640613 0.71
SCHEMBL9839871 0.71
SCHEMBL7992844 0.71 PTPRZ1 (0.36)
SCHEMBL7992496 0.71 ALDH1A1 (0.39) KDM4EALDH1A1
SCHEMBL20285673 0.71 LMNA (0.34) KDM4EALDH1A1TDP1
SCHEMBL18194086 0.68 SMN1; SMN2 (0.32)
SCHEMBL9840108 0.68 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9838963 0.67 TRPV4 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212600-B1 NITROMETHYLENE DERIVATIVES NIHON BAYER AGROCHEM K.K. (JP) 1991-11-27 EP disclosed
US-4812454-A Nitromethylene derivatives and their use as insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-03-14 US disclosed
US-4772620-A MITICIDES, PARASITICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-09-20 US disclosed
EP-0212600-A2 Nitromethylene derivatives NIHON BAYER AGROCHEM K.K. (JP) 1987-03-04 EP disclosed