SCHEMBL20028548

SCHEMBL20028548

CCOC(=O)c1cn(C(F)F)nc1C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
MAPT P10636 3/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 5/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
DCTPP1 Q9H773 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 2/20 0.39
BAZ2B Q9UIF8 1/20 0.39
BAZ2A Q9UIF9 1/20 0.39
MEN1 O00255 1/20 0.39
HSD17B10 Q99714 1/20 0.39
JMJD6 Q6NYC1 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39

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
SCHEMBL573457 0.86 ADORA3 (0.51) TSHRMAPTKDM4EALDH1A1LMNA
SCHEMBL20028545 0.85 TSHR (0.41) TSHRMAPTKDM4EALDH1A1LMNA
SCHEMBL21570206 0.85 TSHR (0.41) TSHRMAPTKDM4EALDH1A1LMNA
SCHEMBL8786300 0.85 TSHR (0.41) TSHRMAPTKDM4EALDH1A1LMNA
SCHEMBL4218259 0.82 KDM4E (0.48) TSHRMAPTKDM4EALDH1A1L3MBTL1
SCHEMBL15750534 0.79 ALDH1A1 (0.48) MAPTKDM4EALDH1A1LMNANPC1
SCHEMBL17437947 0.79 TSHR (0.42) TSHRMAPTKDM4EALDH1A1LMNA
SCHEMBL22637868 0.78 ALKBH1 (0.36) TSHRMAPTKDM4EALDH1A1L3MBTL1
SCHEMBL3267578 0.78 TSHR (0.50) TSHRMAPTKDM4EALDH1A1DCTPP1
SCHEMBL17162371 0.78 ADORA3 (0.44) KDM4EALDH1A1LMNAL3MBTL1NPC1

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-20260069602-A1 COMPOUNDS, COMPOSITIONS, AND METHODS ACONCAGUA BIO INC (US) 2026-03-12 US disclosed
WO-2018064119-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. (US) 2018-04-05 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 (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-20260069602-A1 COMPOUNDS, COMPOSITIONS, AND METHODS SCTR, SSTR1, NPY1R TSHR 89/4885MAPT 3266/4885KDM4E 4878/4885

“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.