SCHEMBL8204201

SCHEMBL8204201

CCC1OCc2c(F)c(F)cc3c(=O)c(OC(=O)O)cn1c23

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
LMNA P02545 1/20 0.34
KDM4E B2RXH2 7/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 4/20 0.33
HSD17B10 Q99714 4/20 0.33
TOP2A P11388 4/20 0.33
TOP2B Q02880 4/20 0.33
PMP22 Q01453 1/20 0.33
STAT3 P40763 1/20 0.33
ADRB2 P07550 1/20 0.32
KCNH2 Q12809 1/20 0.32
KMT2A Q03164 1/20 0.32
ALB P02768 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
TUBB4A P04350 1/20 0.31
POLB P06746 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31

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
SCHEMBL8202076 0.87 LMNA (0.38) CNR1CNR2LMNAKDM4EALDH1A1
SCHEMBL10432947 0.86 LMNA (0.46) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8913187 0.86 CNR1 (0.31) CNR1CNR2
SCHEMBL10433059 0.83 STAT3 (0.48) CNR1CNR2LMNAKDM4EALDH1A1
SCHEMBL8206695 0.79 STAT3 (0.38) CNR1CNR2LMNAKDM4EALDH1A1
SCHEMBL9033931 0.78 LMNA (0.43) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8320158 0.77 LMNA (0.53) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL10433056 0.76 LMNA (0.42) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL10432848 0.73 LMNA (0.51) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8206595 0.73 KDM4E (0.51) LMNAKDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0770083-B1 PYRIDO[3,2,1-i,j][3,1]BENZOXAZINE DERIVATIVES BAYER AG (DE) 2000-08-30 EP disclosed