SCHEMBL947641

SCHEMBL947641

Cc1ncc2n1C(=O)N(C1CCN(C(=O)CCS(=O)(=O)c3ccc(Br)cc3)CC1)C2

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.73
F2 P00734 3/20 0.73
POLB P06746 3/20 0.50
TSHR P16473 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
RECQL P46063 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
EIF4H Q15056 1/20 0.44
LMNA P02545 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 2/20 0.44
GLA P06280 1/20 0.44
GRK2 P25098 1/20 0.44
TDP1 Q9NUW8 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
SCHEMBL948206 0.92 F10 (0.82) F10F2
SCHEMBL948339 0.85 F10 (1.00) F10F2
Hydrochloric Acid SCHEMBL949833 0.84 F10 (0.98) F10F2
SCHEMBL947790 0.81 F10 (0.92) F10F2
SCHEMBL948424 0.78 F10 (0.68) F10F2SMN1; SMN2
SCHEMBL949017 0.77 F10 (0.75) F10F2
SCHEMBL948710 0.77 F10 (0.66) F10F2MEN1KMT2ALMNA
SCHEMBL948708 0.77 F10 (0.66) F10F2MEN1KMT2ALMNA
SCHEMBL949886 0.76 F10 (0.68) F10F2KMT2ALMNAMAPT
SCHEMBL949326 0.75 F10 (0.87) F10F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-01-13 US disclosed
US-20070004736-A1 Imidazole derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-04 US disclosed
EP-1564213-A1 IMIDAZOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2005-08-17 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 (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-20070004736-A1 Imidazole derivative, process for producing the same, and use HRH4, F2, HRH2 F10 545/4885F2 2/4885POLB 2031/4885
US-20110009389-A1 IMIDAZOLE DERIVATIVE, THEIR PRODUCTION AND USE F2, H1-3, CYC1 F10 490/4885F2 1/4885POLB 1843/4885

“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.