SCHEMBL7962887

SCHEMBL7962887

FC(F)(F)COc1c[c]ncn1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
THRB P10828 1/20 0.33
G6PD P11413 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL13721022 0.76
SCHEMBL11901924 0.71 L3MBTL1 (0.41) L3MBTL1MAPTALDH1A1KDM4EMEN1
SCHEMBL28662570 0.69 L3MBTL1 (0.37) L3MBTL1MAPTALDH1A1KDM4EMEN1
SCHEMBL9204361 0.69 KDM4E (0.34) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL791842 0.69 CA2 (0.40)
SCHEMBL8563948 0.68 MAPT (0.40) L3MBTL1MAPTALDH1A1KDM4EMEN1
SCHEMBL8568484 0.67 ALDH1A1 (0.35) L3MBTL1MAPTALDH1A1KDM4EMEN1
SCHEMBL20732653 0.67 L3MBTL1 (0.45) L3MBTL1MAPTALDH1A1KDM4EMEN1
SCHEMBL17309636 0.65 NUDT1 (0.39) L3MBTL1MAPTALDH1A1KDM4EMEN1
SCHEMBL6249154 0.65 MAPT (0.37) L3MBTL1MAPTALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214825-B1 FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-10 US claimed
EP-0586393-B1 SUBSTITUTED-2-PHENYL-3-METHOXYPROPENOATES AS FUNGICIDES ZENECA LTD (GB) 1998-06-17 EP claimed
US-5439910-A For applying to plants, seeds or soils ZENECA LIMITED (GB) 1995-08-08 US claimed