SCHEMBL8950302

SCHEMBL8950302

Cc1ccccc1C1C(=O)N2CCCCN2C1=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HTR2C P28335 3/20 0.38
HTR2A P28223 1/20 0.38
HTR2B P41595 1/20 0.38
HSP90AA1 P07900 4/20 0.37
HSP90AB1 P08238 4/20 0.37
PBRM1 Q86U86 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36

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
SCHEMBL8950283 0.79 SMN1; SMN2 (0.40) ALDH1A1MAPT
SCHEMBL8950295 0.79 CHRNA7 (0.45) TSHRALDH1A1KDM4EMAPT
SCHEMBL8950369 0.73 LMNA (0.43) GAATSHRALDH1A1MAPTHTR2B
SCHEMBL6113569 0.72 CNR2 (0.35) ALDH1A1HTR2CHTR2A
SCHEMBL16592343 0.71 FASN (0.32) ALDH1A1
SCHEMBL11215167 0.71 DDB1 (0.47) GAATSHRDDB1CRBNALDH1A1
SCHEMBL8950304 0.70 KMT2A (0.44) GAAALDH1A1MAPT
SCHEMBL909156 0.70 DDB1 (0.44) DDB1CRBNALDH1A1KDM4EMAPT
SCHEMBL16592329 0.69 FASN (0.33)
SCHEMBL11215533 0.69 DDB1 (0.46) GAATSHRDDB1CRBNALDH1A1

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-A1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS. CIBA GEIGY AG (CH) 1994-01-12 EP claimed
WO-1992016510-A1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS CIBA-GEIGY AG (CH) 1992-10-01 WO 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