SCHEMBL3547033

SCHEMBL3547033

COC(=O)[C@H]1CCCN1C(=S)c1cccc(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 2/20 0.48
PDK2 Q15119 1/20 0.48
HCRTR1 O43613 1/20 0.46
HCRTR2 O43614 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LOX P28300 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.45
TAS1R1 Q7RTX1 1/20 0.45
TAS1R2 Q8TE23 1/20 0.45
GAA P10253 1/20 0.45
CACNA1B Q00975 1/20 0.44
PHGDH O43175 1/20 0.44

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
SCHEMBL3547030 1.00 POLB (0.48) POLBLMNAHPGDKMT2APDK2
SCHEMBL3547423 0.93 LMNA (0.47) POLBLMNAHPGDKMT2APDK2
SCHEMBL3547425 0.93 LMNA (0.47) POLBLMNAHPGDKMT2APDK2
SCHEMBL201319 0.85 POLB (0.49) POLBLMNAHPGDKMT2AHCRTR1
SCHEMBL3551395 0.85 POLB (0.49) POLBLMNAHPGDKMT2AHCRTR1
SCHEMBL3544419 0.84 PDK2 (0.45) POLBLMNAHPGDKMT2APDK2
Hydroxyamine SCHEMBL5238906 0.84 LMNA (0.50) POLBLMNAHPGDKMT2A
Hydroxyamine SCHEMBL5238910 0.84 LMNA (0.50) POLBLMNAHPGDKMT2A
SCHEMBL3545845 0.83 HCRTR1 (0.46) POLBPDK2HCRTR1HCRTR2GAA
SCHEMBL3545842 0.83 HCRTR1 (0.46) POLBPDK2HCRTR1HCRTR2GAA

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-7691843-B2 N-hydroxyamide derivatives possessing antibacterial activity PFIZER INC. (US) 2010-04-06 US disclosed
US-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity VICURON HOLDINGS LLC 2008-03-06 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-20080058304-A1 N-hydroxyamide derivatives possessing antibacterial activity AMDHD2, OGA, ENGASE POLB 516/4885LMNA 3400/4885HPGD 688/4885

“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.