SCHEMBL23873408

SCHEMBL23873408

O=CCn1cc(C(F)(F)F)c(=O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
ALOX12 P18054 1/20 0.39
ADRA1A P35348 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
TK1 P04183 10/20 0.35
TK2 O00142 1/20 0.34
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3558374 0.84 DRD2 (0.41) LMNAALOX12ADRA1ASMN1; SMN2DRD2
SCHEMBL3564835 0.81 DRD2 (0.44) LMNAALOX12ADRA1ASMN1; SMN2DRD2
SCHEMBL1484499 0.81 DRD2 (0.42) LMNAALOX12ADRA1ASMN1; SMN2DRD2
SCHEMBL2559163 0.77 KDM4E (0.50) LMNASMN1; SMN2TK1GRIA1GRIA2
SCHEMBL23873406 0.75 GRIA1 (0.42) LMNAALOX12ADRA1ASMN1; SMN2DRD2
SCHEMBL8768989 0.75 KMT2A (0.43) LMNAALOX12ADRA1ASMN1; SMN2DRD2
SCHEMBL13314160 0.74 CYP1A2 (0.50) LMNASMN1; SMN2DRD2DRD3TK1
SCHEMBL3561793 0.74 DRD2 (0.46) LMNAALOX12ADRA1ASMN1; SMN2DRD2
SCHEMBL6714052 0.74 TK1 (0.57) TK1TK2
SCHEMBL31087986 0.74 CYP1A2 (0.50) TK1GRIA1GRIA2GRIA4KMT2A

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-20230129710-A1 Methods and Reagents for Synthesizing Nucleosides and Analogues Thereof SIMON FRASER UNIVERSITY (CA) 2023-04-27 US disclosed
WO-2021191830-A1 METHODS AND REAGENTS FOR SYNTHESIZING NUCLEOSIDES AND ANALOGUES THEREOF SIMON FRASER UNIVERSITY (CA) 2021-09-30 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-20230129710-A1 Methods and Reagents for Synthesizing Nucleosides and Analogues Thereof NUDT1, ADAR, APRT LMNA 1420/4885ALOX12 2938/4885ADRA1A 1941/4885

“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.