SCHEMBL8489359

SCHEMBL8489359

O=C(c1ccc(Cl)cc1Cl)c1cnoc1C1CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.42
CASP1 P29466 1/20 0.42
SRD5A2 P31213 1/20 0.42
PPARG P37231 1/20 0.41
NCOA2 Q15596 1/20 0.41
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
RAB9A P51151 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 1/20 0.40
HIF1A Q16665 1/20 0.40

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
SCHEMBL9115363 0.86 DHODH (0.38) SMN1; SMN2MAPTHPGDLMNAHTT
SCHEMBL8814817 0.86 GAA (0.39) SMN1; SMN2MAPTHPGDLMNAHTT
SCHEMBL8489371 0.86 HPGD (0.50) HPGDLMNARAB9AALDH1A1MAPK1
SCHEMBL9113188 0.86 DHODH (0.40) SMN1; SMN2MAPTHPGDLMNAHTT
SCHEMBL8492226 0.86 HTT (0.39) MAPTHPGDLMNAHTTCASP1
SCHEMBL9116187 0.86 DHODH (0.38) SMN1; SMN2MAPTHPGDLMNAHTT
SCHEMBL8492789 0.84 DHODH (0.44) SMN1; SMN2MAPTRAB9ACYP1A2CYP2D6
SCHEMBL8495024 0.84 DHODH (0.52) SMN1; SMN2MAPTLMNAHTTRAB9A
SCHEMBL9114971 0.84 DHODH (0.39) HPGDLMNADHODHMEN1KMT2A
SCHEMBL8491541 0.83 DHODH (0.41) HPGDLMNARAB9ANPC1DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5656573-A Herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-12 US claimed
EP-0418175-B1 Isoxazoles herbicides RHONE POULENC AGRICULTURE (GB) 1996-07-17 EP claimed
EP-0418175-A2 Isoxazoles herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1991-03-20 EP claimed
US-5859283-A TERTIARY-BUTYL 3-CYCLOALKYL-3-OXOPROPIONATE RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-12 US disclosed
US-5747424-A HEATING AN AROMATIC DIKETONE WITH A SALT OF HYDROXYLAMINE IN A SOLVENT RHONE-POULENC AGRICULTURE LTD. (GB) 1998-05-05 US disclosed
US-5656573-A Herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-12 US disclosed
US-5650533-A Intermediates to herbicidal 4-substituted isoxazoles RHONE-POULENC AGRICULTURE LTD. (GB) 1997-07-22 US disclosed
EP-0418175-B1 Isoxazoles herbicides RHONE POULENC AGRICULTURE (GB) 1996-07-17 EP disclosed
WO-1995022904-A1 PESTICIDAL METHOD RHONE POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed
EP-0418175-A2 Isoxazoles herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1991-03-20 EP disclosed