SCHEMBL8556616

SCHEMBL8556616

O=C1COc2ccccc2N1Cc1cc(Cl)cc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.65
L3MBTL1 Q9Y468 1/20 0.64
DRD4 P21917 1/20 0.59
USP2 O75604 1/20 0.56
GRM5 P41594 2/20 0.55
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 1/20 0.49
CBX7 O95931 1/20 0.48
CDYL2 Q8N8U2 1/20 0.48
CDYL Q9Y232 1/20 0.48
CDY1; CDY1B Q9Y6F8 1/20 0.48
CYP1A2 P05177 1/20 0.48
GAA P10253 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
BRD4 O60885 2/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL8554874 0.89 USP2 (0.63) TSHRL3MBTL1DRD4USP2GRM5
SCHEMBL31667554 0.82 L3MBTL1 (0.70) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL8556518 0.82 TSHR (0.60) TSHRL3MBTL1DRD4USP2GRM5
SCHEMBL4506469 0.78 ALDH1A1 (0.69) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL8554715 0.78 L3MBTL1 (1.00) TSHRL3MBTL1DRD4KMT2AMEN1
SCHEMBL13973048 0.78 SLC5A1 (0.45) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL8553880 0.77 L3MBTL1 (0.64) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL18581120 0.77 MAPT (0.52) TSHRUSP2KMT2AMEN1LMNA
SCHEMBL29790744 0.77 MAPT (0.52) TSHRUSP2KMT2AMEN1LMNA
SCHEMBL4477873 0.76 L3MBTL1 (0.58) TSHRL3MBTL1MAPTCBX7CDYL2

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-0869949-A1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1998-10-14 EP disclosed
WO-1997017333-A1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-05-15 WO disclosed