SCHEMBL148789

SCHEMBL148789

Fc1ccc(-n2ccc3c(Br)cccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CYP19A1 P11511 1/20 0.39
KCNH2 Q12809 3/20 0.39
GRM2 Q14416 1/20 0.37
HSP90AA1 P07900 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
BIRC5 O15392 1/20 0.35
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34

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
SCHEMBL15741220 0.84 HSP90AA1 (0.41) HSP90AA1BIRC5
SCHEMBL4880774 0.81 ALDH1A1 (0.44) ALDH1A1CYP19A1KCNH2BIRC5PTGS1
SCHEMBL23883491 0.79 KCNH2 (0.42) ALDH1A1KCNH2
SCHEMBL30335333 0.79 KCNH2 (0.42) ALDH1A1KCNH2
SCHEMBL30234615 0.77 FFAR4 (0.52) ALDH1A1KCNH2
SCHEMBL23883999 0.77 FFAR4 (0.52) ALDH1A1KCNH2
SCHEMBL1874901 0.77 KCNH2 (0.37) ALDH1A1CYP19A1KCNH2PTGS2
SCHEMBL2610313 0.74 KDM4E (0.50) ALDH1A1
SCHEMBL122228 0.72 HTR6 (0.52) ALDH1A1CYP19A1GRM2HSP90AA1
SCHEMBL17740589 0.71 KDM4E (0.37) HSP90AA1BIRC5

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-20120058996-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 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-20120058996-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BTK, FLT3, JAK1 ALDH1A1 3832/4885CYP19A1 1736/4885KCNH2 2449/4885

“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.