SCHEMBL571667

SCHEMBL571667

O=C1c2c(O)cc(O)cc2OCC1(Cl)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.41
CYP3A4 P08684 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP1A1 P04798 3/20 0.41
CYP1A2 P05177 3/20 0.41
CYP1B1 Q16678 3/20 0.41
CYP2C19 P33261 3/20 0.41
CYP2C9 P11712 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.41
CYP2D6 P10635 1/20 0.41
PNLIP P16233 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
ALDH1A1 P00352 2/20 0.37
BCL2 P10415 1/20 0.35
MCL1 Q07820 1/20 0.35
TTR P02766 3/20 0.34
ESR1 P03372 2/20 0.34

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
SCHEMBL28636154 0.78 MAPT (0.39) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL8572826 0.78 CYP19A1 (0.37) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL8575536 0.75 CYP19A1 (0.37) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL911922 0.73 ALDH1A1 (0.44) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL20550365 0.72 MAOA (0.45) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL2852450 0.72 PKM (0.42) CYP19A1CYP3A4MEN1KMT2ACYP2C19
SCHEMBL3937086 0.68 MAOA (0.41) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL29462263 0.67 MET (0.45) CYP19A1CYP3A4MEN1KMT2ACYP1A1
SCHEMBL8577569 0.66 ABCG2 (0.42) CYP19A1CYP3A4CYP2C19CYP2C9MAPT
SCHEMBL27586967 0.66 ALDH1A1 (0.41) CYP19A1CYP3A4MEN1KMT2ACYP1A1

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-2598150-A2 COMPOSITIONS FOR PROLIFERATION OF CELLS AND RELATED METHODS The Hospital For Sick Children (CA) 2013-06-05 EP disclosed
WO-2012018643-A2 COMPOSITIONS FOR PROLIFERATION OF CELLS AND RELATED METHODS THE HOSPITAL FOR SICK CHILDREN (CA) 2012-02-09 WO disclosed