SCHEMBL5747154

SCHEMBL5747154

COC(=O)C(=O)C(Br)c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KCNA5 P22460 6/20 0.45
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
TBXAS1 P24557 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4D Q08499 1/20 0.40

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
Bromide SCHEMBL5747147 0.98 ALDH1A1 (0.45) ALDH1A1KCNA5LMNASMN1; SMN2MAPT
SCHEMBL8948339 0.84 ALDH1A1 (0.49) ALDH1A1KCNA5LMNASMN1; SMN2POLB
SCHEMBL5746915 0.84 GAA (0.46) ALDH1A1KCNA5LMNASMN1; SMN2MAPT
Bromide SCHEMBL5746911 0.82 GAA (0.45) ALDH1A1KCNA5LMNASMN1; SMN2MAPT
SCHEMBL7260309 0.78 SMN1; SMN2 (0.55) ALDH1A1KCNA5LMNASMN1; SMN2CES2
SCHEMBL3467316 0.75 GAA (0.48) ALDH1A1KCNA5LMNASMN1; SMN2MAPT
SCHEMBL13924228 0.75 GAA (0.48) ALDH1A1KCNA5LMNASMN1; SMN2MAPT
SCHEMBL27903781 0.75 F7 (0.48) ALDH1A1KCNA5LMNASMN1; SMN2MAPT
SCHEMBL11148954 0.74 SMN1; SMN2 (0.43) LMNASMN1; SMN2POLBTBXAS1
SCHEMBL9462640 0.74 RAB9A (0.43) KCNA5LMNASMN1; SMN2POLBTBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664040-A1 GYRASE INHIBITORS PFIZER INC. (US) 2006-06-07 EP disclosed
US-6984652-B2 Gyrase inhibitors WARNER-LAMBERT COMPANY LLC (US) 2006-01-10 US disclosed
US-20050250823-A1 Gyrase inhibitors YAGER KRAIG 2005-11-10 US disclosed
WO-2005026162-A1 GYRASE INHIBITORS PFIZER INC. (US) 2005-03-24 WO disclosed
US-20050054697-A1 Gyrase inhibitors PFIZER INC. 2005-03-10 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 (2 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-20050054697-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B ALDH1A1 2272/4885KCNA5 4684/4885LMNA 881/4885
US-20050250823-A1 Gyrase inhibitors TOP1, TOP2A, TOP2B ALDH1A1 2272/4885KCNA5 4684/4885LMNA 881/4885

“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.