SCHEMBL6848304

SCHEMBL6848304

COC(=O)CCCC=C(F)F

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
EPHX2 P34913 1/20 0.39
TBXAS1 P24557 1/20 0.38
CA12 O43570 1/20 0.36
CA14 Q9ULX7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RECQL P46063 1/20 0.36
GLA P06280 1/20 0.36
OXER1 Q8TDS5 2/20 0.36
ALOX5 P09917 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
SCHEMBL6854895 0.92 LMNA (0.61) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10412439 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10412779 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10411594 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10412778 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10413172 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10412438 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10411593 0.82 TSHR (0.50) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10412128 0.81 TSHR (0.48) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL10412126 0.81 TSHR (0.48) TSHRLMNAALDH1A1MEN1KMT2A

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-0661289-B1 Vinyl carboxamide derivatives as insecticides and acaricides SYNGENTA PARTICIPATIONS AG (CH) 2004-03-03 EP disclosed
US-5763481-A PESTICIDES; INSECTICIDES, MITICIDES NOVARTIS CORPROATION (US) 1998-06-09 US disclosed
US-5545630-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1996-08-13 US disclosed
EP-0661289-A1 Vinyl carboxamide derivatives as insecticides and acaricides CIBA-GEIGY AG (CH) 1995-07-05 EP disclosed
US-5248810-A Insecticides, acaricides SCHERING AKTIENGESELLSCHAFT (DE) 1993-09-28 US disclosed
EP-0432861-A1 Halogenated olefines, process for the preparation thereof and their use as pesticides SCHERING AKTIENGESELLSCHAFT (DE) 1991-06-19 EP disclosed