SCHEMBL19737022

SCHEMBL19737022

C[n+]1cc(N)c(CCCC(O)CN)c(N)c1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
ALOX15 P16050 1/20 0.30

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
SCHEMBL19737027 0.95 TSHR (0.30) TSHR
SCHEMBL19736676 0.90
SCHEMBL19737031 0.89
SCHEMBL19737032 0.85
SCHEMBL19736891 0.84
SCHEMBL19736889 0.84
SCHEMBL19736762 0.79 ALDH1A1 (0.34) ALOX15
SCHEMBL19736671 0.79 TSHR (0.34) TSHRALOX15
SCHEMBL19737023 0.77
SCHEMBL19736662 0.75 KDM4E (0.33)

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-11345653-B2 Compositions and methods for reactivating cholinesterases THE HENRY M. JACKSON FOUNDATION FOR THE ADVANCEMENT OF MILITARY MEDICINE INC. (US) 2022-05-31 US disclosed
US-20190345097-A1 Compositions and Methods for Reactivating Cholinesterases The Henry M. Jackson Foundation for the Advancemen t of Military Medicine, Inc. (US) 2019-11-14 US disclosed
WO-2017218886-A1 COMPOSITIONS AND METHODS FOR REACTIVATING CHOLINESTERASES THE HENRY M. JACKSON FOUNDATION FOR THE ADVANCEMENT OF MILITARY MEDICINE, INC. (US) 2017-12-21 WO 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-11345653-B2 Compositions and methods for reactivating cholinesterases ACHE, BCHE, CHAT TSHR 3268/4885ALOX15 1916/4885
US-20190345097-A1 Compositions and Methods for Reactivating Cholinesterases ACHE, BCHE, CHAT TSHR 3268/4885ALOX15 1916/4885

“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.