SCHEMBL14165623

SCHEMBL14165623

COc1ccc2c(c1)CCC(CBr)C2=O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 6/20 0.66
CYP27A1 Q02318 3/20 0.66
CYP26A1 O43174 3/20 0.65
CYP19A1 P11511 3/20 0.65
METAP1 P53582 2/20 0.59
THRA P10827 1/20 0.52
THRB P10828 1/20 0.52
ACHE P22303 1/20 0.49

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
SCHEMBL630276 0.87 CYP24A1 (0.70) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
SCHEMBL14159089 0.86 CYP24A1 (0.69) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
SCHEMBL8012038 0.84 METAP1 (0.78) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
SCHEMBL7590283 0.84 METAP1 (0.78) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
SCHEMBL26063574 0.83 CYP24A1 (0.62) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
Hydrochloric Acid SCHEMBL10341505 0.83 METAP1 (0.78) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
Iodide SCHEMBL4621278 0.82 CYP24A1 (0.61) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
SCHEMBL7245357 0.82 CYP24A1 (0.80) CYP24A1CYP27A1CYP26A1CYP19A1ACHE
SCHEMBL10341545 0.82 CYP24A1 (0.61) CYP24A1CYP27A1CYP26A1CYP19A1METAP1
SCHEMBL8200552 0.82 CYP24A1 (0.61) CYP24A1CYP27A1CYP26A1CYP19A1METAP1

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
US-20080139574-A1 Novel quinoline derivatives CADILA HEALTHCARE LIMITED 2008-06-12 US disclosed
US-20080139574-A1 Novel quinoline derivatives CADILA HEALTHCARE LIMITED 2008-06-12 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-20080139574-A1 Novel quinoline derivatives UGT1A7, CYP3A5, CYP3A7 CYP24A1 3861/4885CYP27A1 711/4885CYP26A1 533/4885

“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.