SCHEMBL5221860

SCHEMBL5221860

COc1ccc(C(=O)Nc2cc(OC)ccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.83
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
MAPT P10636 5/20 0.66
TP53 P04637 2/20 0.65
GAA P10253 2/20 0.65
ALDH1A1 P00352 3/20 0.60
LMNA P02545 3/20 0.60
ALOX15 P16050 1/20 0.60
APEX1 P27695 1/20 0.60
MAPK1 P28482 1/20 0.60
RECQL P46063 1/20 0.60
HSD17B10 Q99714 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
NR1H4 Q96RI1 4/20 0.60
PPARG P37231 1/20 0.60
PPARD Q03181 1/20 0.60
GPBAR1 Q8TDU6 1/20 0.60
KDM4E B2RXH2 2/20 0.58
HPGD P15428 2/20 0.58

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
SCHEMBL7250878 0.91 F10 (1.00) F10MEN1KMT2AMAPTTP53
SCHEMBL5223327 0.91 F10 (0.68) F10MEN1KMT2AMAPTTP53
SCHEMBL5308412 0.91 F10 (0.68) F10MEN1KMT2AMAPTTP53
SCHEMBL5221185 0.91 MEN1 (0.84) F10MEN1KMT2AMAPTALDH1A1
SCHEMBL5224928 0.91 MEN1 (0.84) F10MEN1KMT2AMAPTALDH1A1
SCHEMBL7295108 0.87 TP53 (0.81) F10MEN1KMT2AMAPTTP53
SCHEMBL7302105 0.87 SMN1; SMN2 (0.75) F10MEN1KMT2AMAPTTP53
SCHEMBL5224056 0.86 F10 (0.61) F10MEN1KMT2AMAPTTP53
SCHEMBL7301192 0.82 NPC1 (0.81) MEN1KMT2AMAPTTP53GAA
SCHEMBL7304276 0.82 NPC1 (0.81) MEN1KMT2AMAPTTP53GAA

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
EP-1014962-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2007-06-27 EP disclosed
EP-1014962-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
WO-1999000121-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed