SCHEMBL11077841

SCHEMBL11077841

C=C(COc1ccccc1)C(=O)Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.59
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
ALPL P05186 1/20 0.47
ALPI P09923 1/20 0.47
ALPG P10696 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
GAA P10253 2/20 0.45
FFAR1 O14842 1/20 0.44
GPR174 Q9BXC1 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
PTPN7 P35236 1/20 0.43
PTPN12 Q05209 1/20 0.43
PKM P14618 1/20 0.43
GLA P06280 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL632411 0.84 ALOX15 (0.63) ALOX15KMT2AMEN1ALPLALPI
Hydrochloric Acid SCHEMBL11077850 0.82 ALOX15 (0.61) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL11071525 0.81 MAPT (0.51) KMT2AMEN1NPC1HPGDGAA
SCHEMBL11096716 0.81 WDR5 (0.55) GAAFFAR1ALDH1A1MAPTLMNA
SCHEMBL12384171 0.81 ALOX15 (0.59) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL11114121 0.81 ALOX15 (0.59) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL4641326 0.80 ALOX15 (0.63) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL23229176 0.79 ALOX15 (0.56) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL6013 0.79 ALOX15 (0.68) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL11439238 0.79 ALOX15 (0.56) ALOX15KMT2AMEN1ALPLALPI

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
EP-0118685-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-19 EP disclosed
EP-0117412-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-05 EP disclosed