SCHEMBL19953987

SCHEMBL19953987

C=Nc1cc(C)cnc1/C=C\C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 2/20 0.31
CCR1 P32246 1/20 0.31
CCR5 P51681 1/20 0.31
CCR8 P51685 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31

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
SCHEMBL21710342 0.77 NOS2 (0.32) NOS2
SCHEMBL7235622 0.75 NOS2 (0.45) NOS2CCR1CCR5CCR8NOS3
SCHEMBL7235627 0.75 NOS2 (0.45) NOS2CCR1CCR5CCR8NOS3
SCHEMBL13771122 0.73 NOS2 (0.31) NOS2CCR1CCR5CCR8NOS3
SCHEMBL14421997 0.73 NOS2 (0.31) NOS2CCR1CCR5CCR8NOS3
SCHEMBL18198308 0.72 NOS2 (0.42) NOS2CCR1CCR5CCR8NOS3
SCHEMBL20320657 0.71 NOS2 (0.31) NOS2CCR1CCR5CCR8NOS3
SCHEMBL23732288 0.69 NOS2 (0.34) NOS2CCR1CCR5CCR8NOS3
SCHEMBL21499260 0.67 MAPT (0.36)
SCHEMBL7912753 0.67 NOS3 (0.36) NOS2CCR1CCR5CCR8NOS3

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-11245078-B2 Thermally activated delayed fluorescent material based on 9,10-dihydro-9,9-dimethylacridine analogues for prolonging device longevity ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-02-08 US disclosed
US-20200075868-A1 Thermally Activated Delayed Fluorescent Material Based on 9,10-Dihydro-9,9-dimethylacridine Analogues for Prolonging Device Longevity UNIV ARIZONA STATE (US) 2020-03-05 US disclosed
US-9917262-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-13 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-11245078-B2 Thermally activated delayed fluorescent material based on 9,10-dihydro-9,9-dimethylacridine analogues for prolonging device longevity HSPA9, CASP9, PARP9 NOS2 1360/4885CCR1 4378/4885CCR5 3281/4885
US-20200075868-A1 Thermally Activated Delayed Fluorescent Material Based on 9,10-Dihydro-9,9-dimethylacridine Analogues for Prolonging Device Longevity HSPA9, CASP9, PARP9 NOS2 1360/4885CCR1 4378/4885CCR5 3281/4885

“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.