SCHEMBL10472437

SCHEMBL10472437

N#CC(=NO)c1ccc(F)cc1Cl.[NaH]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
LMNA P02545 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 2/20 0.37
CTSL P07711 1/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRB2 P47870 1/20 0.36
HSD11B1 P28845 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
PYGL P06737 3/20 0.33
P2RX7 Q99572 2/20 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
SCHEMBL9823228 0.98 HPGD (0.40) HPGDLMNAALDH1A1MAPTHTT
SCHEMBL10472439 0.97 HPGD (0.39) HPGDLMNAALDH1A1MAPTHTT
SCHEMBL3675507 0.81 MEN1 (0.55) HPGDLMNAALDH1A1MAPTGABRA1
SCHEMBL3680287 0.81 CES2 (0.47) LMNAALDH1A1MAPTHTTRAB9A
SCHEMBL3680288 0.81 CES2 (0.47) LMNAALDH1A1MAPTHTTRAB9A
SCHEMBL3675506 0.81 MEN1 (0.55) HPGDLMNAALDH1A1MAPTGABRA1
SCHEMBL3436492 0.81 MEN1 (0.55) HPGDLMNAALDH1A1MAPTGABRA1
SCHEMBL3680333 0.77 CES2 (0.47) LMNAALDH1A1MAPTHTT
SCHEMBL3680330 0.77 CES2 (0.47) LMNAALDH1A1MAPTHTT
SCHEMBL10472622 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4950777-A Herbicidally active derivatives of N-phenyl-3,4,5,6-tetrahydrophthalimide CIBA-GEIGY CORPORATION (US) 1990-08-21 US disclosed
US-4824476-A PLANT GROWTH REGULATOR CIBA-GEIGY CORPORATION (US) 1989-04-25 US disclosed