SCHEMBL8950185

SCHEMBL8950185

O=C1C(c2c(Cl)cccc2Cl)C(=O)N2CCCCN12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 1/20 0.41
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 3/20 0.39
MAPK1 P28482 1/20 0.39
AADAT Q8N5Z0 2/20 0.38
NSD2 O96028 1/20 0.37
ALDH1A1 P00352 6/20 0.37
KDM4E B2RXH2 4/20 0.36
POLB P06746 2/20 0.35
ATM Q13315 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL8950233 0.89 MAPT (0.41) SMN1; SMN2TSHRMAPTMAPK1NSD2
SCHEMBL8950295 0.80 CHRNA7 (0.45) SMN1; SMN2TSHRMAPTALDH1A1KDM4E
SCHEMBL8950429 0.74 ALDH1A1 (0.46) TSHRHPGDMAPTALDH1A1KDM4E
SCHEMBL9536702 0.73 SMN1; SMN2 (0.39) SMN1; SMN2TSHRHPGDAADATNSD2
SCHEMBL16562616 0.73
SCHEMBL8950527 0.72 ALDH1A1 (0.46) SMN1; SMN2TSHRMAPK1ALDH1A1KDM4E
SCHEMBL16562484 0.72 ALDH1A1 (0.30) ALDH1A1POLB
SCHEMBL8950369 0.71 LMNA (0.43) TSHRMAPTMAPK1ALDH1A1MEN1
SCHEMBL16562608 0.69 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL9482529 0.68 SMN1; SMN2 (0.37) SMN1; SMN2HPGDMAPTMAPK1AADAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0577629-B1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS CIBA GEIGY AG (CH) 1996-06-26 EP claimed
EP-0577629-B1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS CIBA GEIGY AG (CH) 1996-06-26 EP disclosed
US-5506193-A Herbicidally, acaricidally and insecticidally active pyrazolidine compounds CIBA-GEIGY CORPORATION (US) 1996-04-09 US disclosed
US-5494890-A FOR CONTROLLING WEEDS, INSECTS, MITES CIBA-GEIGY CORPORATION (US) 1996-02-27 US disclosed
EP-0577629-A1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS. CIBA GEIGY AG (CH) 1994-01-12 EP disclosed
WO-1992016510-A1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS CIBA-GEIGY AG (CH) 1992-10-01 WO disclosed