SCHEMBL144485

SCHEMBL144485

O=c1ccn(C2CC2)c2c(O)c(F)ccc12

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 12/20 0.46
TOP2B Q02880 12/20 0.46
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CG P48736 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
AOC3 Q16853 1/20 0.32
P2RX7 Q99572 1/20 0.32

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
SCHEMBL143295 0.73 TOP2A (0.60) TOP2ATOP2BLMNAPOLBPIK3CD
Bicarbonate SCHEMBL9047917 0.72 TOP2A (0.58) TOP2ATOP2B
SCHEMBL10808897 0.71 TOP2A (0.62) TOP2ATOP2B
SCHEMBL8452757 0.71 TOP2A (0.53) TOP2ATOP2B
SCHEMBL30906940 0.70 MAT2A (0.45) TOP2ATOP2BAOC3
SCHEMBL29742967 0.70 TOP2A (0.49) TOP2ATOP2BLMNAPIK3CDPIK3R1
SCHEMBL10475103 0.70 TOP2A (0.49) TOP2ATOP2BLMNAPIK3CDPIK3R1
Bicarbonate SCHEMBL11112814 0.70 TOP2A (0.58) TOP2ATOP2B
Hydrochloric Acid SCHEMBL29744471 0.69 TOP2A (0.48) TOP2ATOP2BLMNAPIK3CDPIK3R1
SCHEMBL10510897 0.69 TOP2A (0.54) TOP2ATOP2BJAK2JAK1P2RX7

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
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS ACHAOGEN, INC. (US) 2012-03-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120058989-A1 ANTIBACTERIAL FLUOROQUINOLONE ANALOGS RECQL, BLVRB, NQO2 TOP2A 125/4885TOP2B 31/4885LMNA 2216/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.