SCHEMBL8556518

SCHEMBL8556518

O=C1COc2ccccc2N1Cc1csc(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.60
L3MBTL1 Q9Y468 1/20 0.59
DRD4 P21917 1/20 0.52
USP2 O75604 1/20 0.49
GRM5 P41594 1/20 0.48
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
PIK3CG P48736 1/20 0.45
CBX7 O95931 1/20 0.45
CDYL2 Q8N8U2 1/20 0.45
CDYL Q9Y232 1/20 0.45
CDY1; CDY1B Q9Y6F8 1/20 0.45
BRD4 O60885 2/20 0.44
ALDH1A1 P00352 1/20 0.43
DRD2 P14416 1/20 0.43
HTR2A P28223 1/20 0.43
MCHR1 Q99705 1/20 0.43
ALOX12 P18054 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
SCHEMBL8556616 0.82 TSHR (0.65) TSHRL3MBTL1DRD4USP2GRM5
SCHEMBL8554874 0.80 USP2 (0.63) TSHRL3MBTL1DRD4USP2GRM5
SCHEMBL31667554 0.78 L3MBTL1 (0.70) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL4506469 0.74 ALDH1A1 (0.69) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL8554715 0.74 L3MBTL1 (1.00) TSHRL3MBTL1DRD4KMT2AMEN1
SCHEMBL8553880 0.73 L3MBTL1 (0.64) TSHRL3MBTL1DRD4USP2KMT2A
SCHEMBL18497019 0.71 BRD4 (0.58) TSHRL3MBTL1DRD4KMT2AMEN1
SCHEMBL3660420 0.71 BRD4 (0.58) TSHRL3MBTL1KMT2AMEN1LMNA
SCHEMBL8554042 0.71 L3MBTL1 (0.70) TSHRL3MBTL1USP2KMT2AMEN1
SCHEMBL474614 0.70 TSHR (0.60) TSHRL3MBTL1USP2KMT2AMEN1

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