SCHEMBL11707482

SCHEMBL11707482

O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)OCC(Cl)(Cl)Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.46
MAPK1 P28482 2/20 0.35
HIF1A Q16665 1/20 0.35
ALDH1A1 P00352 4/20 0.33
PKM P14618 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
USP2 O75604 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRA6 Q16445 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL7907406 0.81 HSP90AA1 (0.54) HSP90AA1MAPK1HIF1AALDH1A1PKM
SCHEMBL65066 0.78 HSP90AA1 (0.50) HSP90AA1ALDH1A1MEN1KMT2ATSHR
Bromide SCHEMBL6879691 0.77 HSP90AA1 (0.49) HSP90AA1ALDH1A1MEN1KMT2ATSHR
SCHEMBL2389657 0.77 HCAR2 (0.57) HSP90AA1MAPK1ALDH1A1KMT2ATSHR
Hydrochloric Acid SCHEMBL9061399 0.77 HSP90AA1 (0.49) HSP90AA1ALDH1A1MEN1KMT2ATSHR
SCHEMBL12305763 0.77 HCAR2 (0.57) HSP90AA1MAPK1ALDH1A1KMT2ATSHR
SCHEMBL1501229 0.75 PKM (0.54) HSP90AA1MAPK1ALDH1A1PKMMEN1
SCHEMBL2392064 0.75 LMNA (0.50) HSP90AA1ALDH1A1MEN1KMT2AGAA
SCHEMBL6290042 0.75 HSP90AA1 (0.47) HSP90AA1MAPK1ALDH1A1PKMMEN1
SCHEMBL11686008 0.75 LMNA (0.40) MAPK1HIF1AALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4065620-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1977-12-27 US disclosed