SCHEMBL8320158

SCHEMBL8320158

CC1CCc2c(F)c(F)cc3c(=O)c(OC(=O)O)cn1c23

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
KDM4E B2RXH2 6/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 1/20 0.48
TOP2A P11388 8/20 0.39
TOP2B Q02880 8/20 0.39
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALB P02768 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
AADAT Q8N5Z0 2/20 0.37
TUBB4A P04350 1/20 0.37
POLB P06746 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37

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
SCHEMBL9655734 0.90 LMNA (0.52) LMNAKDM4ESMN1; SMN2CYP1A2TOP2A
SCHEMBL9033931 0.89 LMNA (0.43) LMNAKDM4ESMN1; SMN2CYP1A2TOP2A
SCHEMBL8083425 0.85 LMNA (0.70) LMNAKDM4ESMN1; SMN2CYP1A2TOP2A
SCHEMBL4638291 0.84 LMNA (0.78) LMNAKDM4ESMN1; SMN2CYP1A2ALDH1A1
SCHEMBL3890878 0.84 LMNA (0.78) LMNAKDM4ESMN1; SMN2CYP1A2ALDH1A1
SCHEMBL8202076 0.82 LMNA (0.38) LMNAKDM4ESMN1; SMN2CYP1A2TOP2A
SCHEMBL9526680 0.81 KDM4E (0.73) LMNAKDM4ESMN1; SMN2CYP1A2TOP2A
SCHEMBL8038099 0.80 LMNA (0.53) LMNAKDM4ESMN1; SMN2CYP1A2TOP2A
SCHEMBL4393771 0.79 KDM4E (0.55) KDM4ESMN1; SMN2CYP1A2TOP2ATOP2B
SCHEMBL6240622 0.79 KDM4E (0.55) KDM4ESMN1; SMN2CYP1A2TOP2ATOP2B

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-0705828-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1999-12-01 EP disclosed
EP-0705828-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-04-10 EP disclosed