SCHEMBL7220586

SCHEMBL7220586

O=C1NC(=O)C(Cc2ccc(NC(=O)c3cc(=O)c4c(O)cccc4o3)cc2)S1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLH Q9Y253 1/20 0.59
ABCB1 P08183 1/20 0.47
MAPT P10636 2/20 0.46
MAOB P27338 4/20 0.45
MAOA P21397 2/20 0.45
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 2/20 0.42
NPC1 O15118 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PPARG P37231 2/20 0.42
FFAR1 O14842 3/20 0.40
PPARA Q07869 1/20 0.40
MPC2 O95563 1/20 0.40
CYP2C8 P10632 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL7237476 0.90 POLH (0.46) POLHMAPTMAOBMAOAMEN1
SCHEMBL7228016 0.89 POLH (0.45) POLHMAPTMAOBMAOAPPARG
SCHEMBL7221825 0.88 MAPT (0.47) POLHMAPTMAOBMAOAMEN1
SCHEMBL7228500 0.87 ABCB1 (0.46) POLHABCB1MAPTMEN1KMT2A
SCHEMBL7221140 0.86 MAOA (0.60) MAPTMAOBMAOAMEN1KMT2A
SCHEMBL7221407 0.85 KMT2A (0.42) POLHABCB1MAPTMAOBMAOA
SCHEMBL7223192 0.85 PPARG (0.47) MAPTMAOAPPARGMPC2CYP2C8
SCHEMBL7230636 0.85 MAOB (0.49) POLHMAPTMAOBMAOAMEN1
SCHEMBL7228191 0.84 POLH (0.41) POLHABCB1MAPTMEN1KMT2A
SCHEMBL7223493 0.83 MAPT (0.45) POLHMAPTMAOBMAOAMEN1

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
US-6552054-B1 For prophylaxis and therapy of bone diseases and chondropathy TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-04-22 US disclosed
EP-1211251-A1 CHROMONE DERIVATIVES, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF Takeda Chemical Industries, Ltd. (JP) 2002-06-05 EP disclosed