SCHEMBL21021176

SCHEMBL21021176

CCc1ccc(C2C(c3cc(Br)cc(Br)c3)C2(O)OC)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL21021706 0.75 CNR1 (0.35) MAPTSMN1; SMN2HTTGAARAB9A
SCHEMBL21021534 0.70 MAPT (0.36) MAPTSMN1; SMN2HTTL3MBTL1GAA
SCHEMBL21021712 0.64 SLC5A2 (0.36) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL21021248 0.63 SLC9A1 (0.39)
Methoxymethane SCHEMBL27325845 0.63 IDO1 (0.46) MAPTHTTL3MBTL1GAARAB9A
SCHEMBL21022153 0.63 KDM1A (0.34) MAPTHTTL3MBTL1KDM4EALDH1A1
SCHEMBL18153987 0.63 MAPT (0.39) MAPTSMN1; SMN2RAB9AALDH1A1
SCHEMBL18153991 0.63 MAPT (0.39) MAPTSMN1; SMN2RAB9AALDH1A1
SCHEMBL12514354 0.62 RXRA (0.41) MAPTSMN1; SMN2HTTRAB9AKDM4E
SCHEMBL21020918 0.62 SLC5A2 (0.35) MAPTGAAALDH1A1

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
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed