SCHEMBL24485258

SCHEMBL24485258

OCc1cc(-c2ncc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KDM4E B2RXH2 3/20 0.54
POLB P06746 1/20 0.54
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
HTT P42858 2/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
GAA P10253 2/20 0.45
PKM P14618 1/20 0.44
MEN1 O00255 1/20 0.41
STAT3 P40763 1/20 0.41
STAT1 P42224 1/20 0.41
CASP3 P42574 1/20 0.41
KMT2A Q03164 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41

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
SCHEMBL6175885 0.86 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL7932200 0.85 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL8665917 0.83 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6176640 0.83 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL27458228 0.83 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6176174 0.81 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6177940 0.81 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6177938 0.80 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL8146716 0.79 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1
SCHEMBL6173806 0.78 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2KDM4EPOLBNPC1

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-116568673-A Herbicidal compounds 先正达农作物保护股份公司 2023-08-08 CN disclosed
WO-2022112072-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-06-02 WO disclosed