SCHEMBL6262192

SCHEMBL6262192

COC(=O)C1=C(C)N=C(OC)N(C)C1c1ccc(F)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 18/20 0.50
ADRA1A P35348 18/20 0.50
ADRA1B P35368 18/20 0.50
NPSR1 Q6W5P4 2/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
HIF1A Q16665 1/20 0.45

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
SCHEMBL2569399 0.86 NPSR1 (0.49) NPSR1LMNATSHRHIF1A
SCHEMBL6194063 0.78 CACNA1F (0.41) ADRA1DADRA1AADRA1B
SCHEMBL7662607 0.76 ADRA1D (0.53) ADRA1DADRA1AADRA1B
SCHEMBL8555300 0.75 ADRA1D (0.45) ADRA1DADRA1AADRA1B
SCHEMBL7944470 0.75 ADRA1D (0.68) ADRA1DADRA1AADRA1B
SCHEMBL6197192 0.74 ADRA1D (0.69) ADRA1DADRA1AADRA1B
SCHEMBL6199928 0.74 ADRA1D (0.69) ADRA1DADRA1AADRA1B
SCHEMBL7660528 0.74 TSHR (0.51) ADRA1DADRA1AADRA1BNPSR1LMNA
SCHEMBL6199093 0.72 ADRA1D (0.42) ADRA1DADRA1AADRA1BNPSR1LMNA
SCHEMBL6196032 0.72 ADRA1D (0.66) ADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021185-A4 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2005-09-07 EP disclosed
US-20020010186-A1 Dihydropyrimidines and uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-01-24 US disclosed
US-6339090-B1 FOR THERAPY OF BENIGN PROSTATIC HYPERPLASIA MERCK & CO., INC. 2002-01-15 US disclosed
US-6245773-B1 BENIGN PROSTATIC HYPERPLAMIA; REDUCTION OF INTRAOCULAR PRESSURE SYNAPTIC PHARMACEUTICAL CORPORATION 2001-06-12 US disclosed
EP-1021185-A1 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-07-26 EP disclosed
US-6057396-A INTERCALATE HAVING MOLAR RATIO OF MODIFIER TO INTERLAYER CATION OF ONE TO FIVE TO ACHIEVE SORPTION AND COMPLEXING BETWEEN ADJACENT LAYERS OF MATERIAL TO EXPAND SPACING AMCOL INTERNATIONAL CORPORATION (US) 2000-05-02 US disclosed
WO-2000006565-A1 ALPHA 1a ADRENERGIC RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2000-02-10 WO disclosed
WO-1997042956-A1 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-11-20 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-20020010186-A1 Dihydropyrimidines and uses thereof QDPR, DPYD, ADRA1D ADRA1D 3/4885ADRA1A 4/4885ADRA1B 9/4885

“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.