SCHEMBL8890935

SCHEMBL8890935

O=C(c1ccccc1Cc1c(F)cccc1F)c1cnoc1C1CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.36
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
P2RX7 Q99572 1/20 0.33
MAPT P10636 2/20 0.33
MAPK14 Q16539 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NR1H4 Q96RI1 2/20 0.32
PKM P14618 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32

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
SCHEMBL8889420 0.90 MEN1 (0.38) DHODHALDH1A1HSD17B10KDM4EHPGD
SCHEMBL8890667 0.89 ALDH1A1 (0.32) DHODHALDH1A1HSD17B10KDM4EHPGD
SCHEMBL8891093 0.89 NR3C1 (0.34) DHODHALDH1A1HSD17B10KDM4EHPGD
SCHEMBL8892029 0.86 MEN1 (0.38) DHODHALDH1A1HSD17B10KDM4EHPGD
SCHEMBL8892417 0.85 MEN1 (0.33) DHODHALDH1A1HSD17B10HPGDMAPT
SCHEMBL8889700 0.84 TSHR (0.42) DHODHALDH1A1KDM4EMAPTMEN1
SCHEMBL8889540 0.84 DHODH (0.32) DHODHALDH1A1HSD17B10MAPTTSHR
SCHEMBL8890835 0.84 DHODH (0.32) DHODHALDH1A1HSD17B10KDM4EHPGD
SCHEMBL8892743 0.84 HPGD (0.38) DHODHALDH1A1HSD17B10HPGDMAPT
SCHEMBL8891781 0.82 DHODH (0.36) DHODHALDH1A1MAPTLMNATSHR

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
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed