SCHEMBL7576971

SCHEMBL7576971

CCc1c(C(=O)O)c(=O)c2ccc(Br)c(OC)c2n1C1CC1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
SIGMAR1 Q99720 4/20 0.34
DRD2 P14416 3/20 0.34
DRD3 P35462 3/20 0.34
DRD4 P21917 2/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
CYP2D6 P10635 1/20 0.34
ADRA2C P18825 1/20 0.34
CYP2C19 P33261 1/20 0.34
ADRA1A P35348 1/20 0.34
HTR2B P41595 1/20 0.34
HIF1A Q16665 1/20 0.34
GSK3B P49841 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
SCHEMBL6218399 0.88 KCNH2 (0.38) KCNH2MEN1KMT2AMAPTDRD2
SCHEMBL140764 0.87 KCNH2 (0.37) KCNH2MEN1KMT2AALOX15GSK3B
SCHEMBL6220871 0.83 MAPT (0.35) KCNH2MAPTCYP2D6CYP2C19
SCHEMBL6215704 0.80 CA12 (0.41) MEN1KMT2A
SCHEMBL3337171 0.80 KCNH2 (0.41) KCNH2MEN1KMT2AALOX15GSK3B
SCHEMBL589957 0.78 MEN1 (0.47) MEN1KMT2AUSP2MAPTALOX15
SCHEMBL141817 0.76 TOP2A (0.33) KCNH2MEN1KMT2AMAPTGSK3B
SCHEMBL591459 0.76 MEN1 (0.45) MEN1KMT2AUSP2MAPTALOX15
SCHEMBL141441 0.76 KCNH2 (0.31) KCNH2DRD2DRD3DRD4
SCHEMBL14760221 0.76 KMT2A (0.44) MEN1KMT2AUSP2MAPTALOX15

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-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials ABBOTT LABORATORIES 2002-04-25 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-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials NQO2, NQO1, NDUFA7 KCNH2 2211/4885MEN1 1235/4885KMT2A 3343/4885

“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.