SCHEMBL25409359

SCHEMBL25409359

Cc1cc(-n2nnnc2CN)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 1/20 0.43
RXRA P19793 4/20 0.39
GRIN1 Q05586 4/20 0.39
GRIN2B Q13224 4/20 0.39
KCNH2 Q12809 1/20 0.39
PRMT1 Q99873 1/20 0.38

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
SCHEMBL25407159 0.88 LMNA (0.44) LMNAALDH1A1NPSR1L3MBTL1TP53
SCHEMBL29418000 0.86 TP53 (0.54) LMNAALDH1A1NPSR1L3MBTL1TP53
SCHEMBL25211552 0.86 TP53 (0.54) LMNAALDH1A1NPSR1L3MBTL1TP53
SCHEMBL25217469 0.86 ALDH1A1 (0.41) LMNAALDH1A1NPSR1L3MBTL1RXRA
SCHEMBL25215864 0.82 ALDH1A1 (0.48) LMNAALDH1A1NPSR1L3MBTL1TP53
SCHEMBL15786415 0.80 NOTUM (0.54) LMNAALDH1A1L3MBTL1RXRAGRIN1
SCHEMBL25213647 0.79 ALDH1A1 (0.48) LMNAALDH1A1NPSR1L3MBTL1KCNH2
SCHEMBL25407987 0.79 TP53 (0.60) LMNATP53
SCHEMBL6541068 0.75 NOTUM (0.46) LMNAALDH1A1L3MBTL1RXRAGRIN1
SCHEMBL25218290 0.74 CYP1A2 (0.60) LMNAALDH1A1NPSR1L3MBTL1

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-20230278984-A1 UREA DERIVATIVES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-09-07 US disclosed
EP-4188542-A1 UREA DERIVATIVES AS PYRUVATE KINASE ACTIVATORS Global Blood Therapeutics, Inc. (US) 2023-06-07 EP disclosed
WO-2022031735-A1 UREA DERIVATIVES AS PYRUVATE KINASE ACTIVATORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2022-02-10 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-20230278984-A1 UREA DERIVATIVES AS PYRUVATE KINASE ACTIVATORS PKM, PDK1, PDK2 LMNA 679/4885ALDH1A1 1945/4885NPSR1 4662/4885

“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.