SCHEMBL11099441

SCHEMBL11099441

O=C(OCc1ccccc1)c1ccc(-c2ccccc2Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.63
TDP1 Q9NUW8 2/20 0.63
SLC6A2 P23975 1/20 0.63
SLC6A3 Q01959 1/20 0.63
LMNA P02545 3/20 0.62
ALDH1A1 P00352 5/20 0.55
MAPT P10636 4/20 0.55
HPGD P15428 1/20 0.55
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
THRB P10828 1/20 0.52
GAA P10253 1/20 0.50
MEN1 O00255 1/20 0.50
PRKCZ Q05513 1/20 0.49
PTGER1 P34995 1/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
PRKDC P78527 1/20 0.46
NPY1R P25929 1/20 0.46

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
SCHEMBL11835196 0.86 PTGER1 (0.45) KMT2ATDP1SLC6A2SLC6A3LMNA
Hydrochloric Acid SCHEMBL11102989 0.85 KMT2A (0.55) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9537786 0.84 KMT2A (0.81) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9537746 0.82 KMT2A (0.79) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL312287 0.82 KMT2A (0.92) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL5924878 0.82 F2RL3 (0.53) KMT2ALMNAALDH1A1MAPTHPGD
SCHEMBL10916834 0.81 KMT2A (0.76) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL2705832 0.81 KMT2A (0.76) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL6393682 0.80 LMNA (0.90) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL10611772 0.80 KMT2A (0.73) KMT2ATDP1SLC6A2SLC6A3LMNA

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
EP-0057141-B1 ESTERS OF HALOGENE-BIPHENYLCARBOXYLATES, METHOD OF PREPARATION AND THEIR APPLICATION AS MEDICINES PIERRE FABRE S.A. (FR) 1984-04-04 EP claimed