SCHEMBL19009024

SCHEMBL19009024

CNC(=O)[C@@H](N)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.31
DPP4 P27487 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PTGS1 P23219 1/20 0.31
KMT2A Q03164 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
SCHEMBL17617087 1.00 MAPT (0.31) MAPTDPP4ALDH1A1PTGS1KMT2A
SCHEMBL25600609 1.00 MAPT (0.31) MAPTDPP4ALDH1A1PTGS1KMT2A
SCHEMBL8202933 0.83 MAPT (0.34) MAPTDPP4ALDH1A1PTGS1
SCHEMBL8426774 0.83 MAPT (0.34) MAPTDPP4ALDH1A1PTGS1
SCHEMBL12867478 0.83 MAPT (0.34) MAPTDPP4ALDH1A1PTGS1
Hydrochloric Acid SCHEMBL1174259 0.81 DPP4 (0.33) MAPTDPP4ALDH1A1PTGS1
SCHEMBL1174655 0.77 DPP4 (0.50) MAPTDPP4ALDH1A1PTGS1
SCHEMBL342534 0.77 DPP4 (0.50) MAPTDPP4ALDH1A1PTGS1
SCHEMBL343358 0.77 DPP4 (0.50) MAPTDPP4ALDH1A1PTGS1
SCHEMBL3171063 0.77 CA2 (0.38)

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-20230303514-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2023-09-28 US disclosed
EP-3497094-B1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2023-02-15 EP disclosed
US-20170174653-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2017-06-22 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-20230303514-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 MAPT 4219/4885DPP4 1575/4885ALDH1A1 2648/4885
US-20170174653-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 MAPT 4252/4885DPP4 1220/4885ALDH1A1 2465/4885

“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.