SCHEMBL7264374

SCHEMBL7264374

Cc1cc2[nH]c(=O)ccc2cc1Br

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.55
CA9 Q16790 3/20 0.55
MAPK1 P28482 4/20 0.49
F11 P03951 1/20 0.46
CA1 P00915 1/20 0.42
CA3 P07451 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA13 Q8N1Q1 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
THRB P10828 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
DAO P14920 1/20 0.39
DDO Q99489 1/20 0.39

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
SCHEMBL2947571 0.84 CA12 (0.62) CA12CA9MAPK1F11CA1
SCHEMBL18822108 0.81 CA12 (0.55) CA12CA9MAPK1F11CA1
SCHEMBL25911641 0.78 CA12 (0.55) CA12CA9MAPK1F11CA1
SCHEMBL1119919 0.78 CA12 (0.55) CA12CA9MAPK1F11CA1
SCHEMBL30908315 0.78 CA12 (0.55) CA12CA9MAPK1F11CA1
SCHEMBL23797291 0.78 CA12 (0.46) CA12CA9MAPK1F11CA1
SCHEMBL4553222 0.77 GRIN2D (0.57) CA12CA9MAPK1F11CA1
SCHEMBL24220101 0.76 CA12 (0.53) CA12CA9MAPK1F11CA1
SCHEMBL17951770 0.75 MAPK1 (0.68) CA12CA9MAPK1F11CA1
SCHEMBL12546048 0.75 CA12 (0.51) CA12CA9MAPK1F11CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170291875-A1 QUINOLONES AS INHIBITORS OF CLASS IV BROMODOMAIN PROTEINS UCL BUSINESS PLC (GB) 2017-10-12 US disclosed
US-4710507-A Quinolone inotropic agents PFIZER INC. (US) 1987-12-01 US disclosed
CN-85100796-A The preparation method of qualone derivative 1986-10-01 CN disclosed
EP-0148623-A2 Quinolone inotropic agents Pfizer Limited (GB) 1985-07-17 EP 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-20170291875-A1 QUINOLONES AS INHIBITORS OF CLASS IV BROMODOMAIN PROTEINS BRD4, BRPF3, BRD3 CA12 3674/4885CA9 3195/4885MAPK1 3047/4885

“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.