SCHEMBL8613974

SCHEMBL8613974

O=Cc1ccc(OC(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.56
MEN1 O00255 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B10 Q99714 2/20 0.55
MAPT P10636 6/20 0.55
ALDH1A1 P00352 5/20 0.55
KDM4E B2RXH2 1/20 0.55
HTT P42858 1/20 0.51
ALOX15 P16050 1/20 0.49
GFER P55789 1/20 0.49
PARP10 Q53GL7 1/20 0.49
PARP3 Q9Y6F1 1/20 0.49
RAB9A P51151 1/20 0.47
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 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
SCHEMBL9400232 0.91 KMT2A (0.63) KMT2AMEN1SMN1; SMN2HSD17B10MAPT
SCHEMBL4243129 0.91 KMT2A (0.63) KMT2AMEN1SMN1; SMN2HSD17B10MAPT
SCHEMBL10599787 0.87 KMT2A (0.69) KMT2AMEN1SMN1; SMN2HSD17B10MAPT
SCHEMBL9683516 0.87 KMT2A (0.69) KMT2AMEN1SMN1; SMN2HSD17B10MAPT
SCHEMBL610755 0.87 KMT2A (0.69) KMT2AMEN1SMN1; SMN2HSD17B10MAPT
SCHEMBL28003430 0.87 KMT2A (0.69) KMT2AMEN1SMN1; SMN2HSD17B10MAPT
SCHEMBL27693913 0.84 ALDH1A1 (0.68) KMT2AMEN1HSD17B10MAPTALDH1A1
SCHEMBL23169792 0.83 KMT2A (0.55) KMT2AHSD17B10MAPTALDH1A1KDM4E
SCHEMBL14513468 0.83 KMT2A (0.69) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL22826428 0.83 KMT2A (0.58) KMT2AMEN1HSD17B10MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0836591-A1 SEMICARBAZONES HAVING CNS ACTIVITY AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME UNIVERSITY OF SASKATCHEWAN (CA) 1998-04-22 EP claimed
WO-1996040628-A1 SEMICARBAZONES HAVING CNS ACTIVITY AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME THE UNIVERSITY OF SASKATCHEWAN (CA) 1996-12-19 WO claimed
EP-0836591-A1 SEMICARBAZONES HAVING CNS ACTIVITY AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME UNIVERSITY OF SASKATCHEWAN (CA) 1998-04-22 EP disclosed
WO-1996040628-A1 SEMICARBAZONES HAVING CNS ACTIVITY AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME THE UNIVERSITY OF SASKATCHEWAN (CA) 1996-12-19 WO disclosed