SCHEMBL25366126

SCHEMBL25366126

COc1cc2c(cnn2-c2ccc(N)cc2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 7/20 0.47
ALDH1A1 P00352 2/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NR3C1 P04150 7/20 0.40
HSP90AB1 P08238 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
PGR P06401 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
SCHEMBL30749607 0.86 MAP4K1 (0.47) MAP4K1ALDH1A1CYP11B1CYP11B2SMN1; SMN2
SCHEMBL27170740 0.86 MAP4K1 (0.47) MAP4K1ALDH1A1CYP11B1CYP11B2SMN1; SMN2
SCHEMBL25369137 0.81 MAPT (0.44) MAP4K1ALDH1A1CYP11B1CYP11B2L3MBTL1
SCHEMBL25368535 0.81 MAP4K1 (0.51) MAP4K1ALDH1A1CYP11B1CYP11B2NR3C1
SCHEMBL27170710 0.81 MAP4K1 (0.45) MAP4K1ALDH1A1CYP11B1CYP11B2NR3C1
SCHEMBL30749628 0.81 MAP4K1 (0.45) MAP4K1ALDH1A1CYP11B1CYP11B2NR3C1
SCHEMBL25367846 0.79 NR3C1 (0.54) MAP4K1CYP11B1CYP11B2NR3C1PGR
SCHEMBL29493820 0.78 NR3C1 (0.47) MAP4K1CYP11B1CYP11B2NR3C1PGR
SCHEMBL25366652 0.78 NR3C1 (0.47) MAP4K1CYP11B1CYP11B2NR3C1PGR
SCHEMBL1541841 0.76 ALDH1A1 (0.54) MAP4K1ALDH1A1CYP11B1CYP11B2NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240083853-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-03-14 US disclosed
CN-116600801-A HSD17B13 inhibitors and uses thereof FL2022-001公司 2023-08-15 CN disclosed
EP-4221701-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, Inc. (US) 2023-08-09 EP disclosed
WO-2022072491-A1 HSD17B13 INHIBITORS AND USES THEREOF METACRINE, INC. (US) 2022-04-07 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-20240083853-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 MAP4K1 3312/4885ALDH1A1 247/4885CYP11B1 16/4885

“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.