SCHEMBL29631908

SCHEMBL29631908

COC(=O)c1cc2cccc(F)c2n1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 13/20 0.39
NR1H3 Q13133 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
ACLY P53396 1/20 0.38
CCR2 P41597 1/20 0.37
TRPV3 Q8NET8 1/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
BACE1 P56817 1/20 0.36

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
SCHEMBL19013556 1.00 NR1H2 (0.39) NR1H2NR1H3L3MBTL1LMNAACLY
SCHEMBL16339758 0.87 CCR2 (0.46) NR1H2NR1H3ACLYCCR2
SCHEMBL29631893 0.86 NR1H2 (0.40) NR1H2NR1H3L3MBTL1
SCHEMBL19013553 0.86 NR1H2 (0.40) NR1H2NR1H3L3MBTL1
SCHEMBL29631879 0.85 NR1H2 (0.39) NR1H2CCR2MAPTALDH1A1TSHR
SCHEMBL19013604 0.85 NR1H2 (0.39) NR1H2CCR2MAPTALDH1A1TSHR
SCHEMBL19014148 0.81 NR1H2 (0.39) NR1H2L3MBTL1LMNAACLYTRPV3
SCHEMBL19013035 0.80 CHRM2 (0.40) NR1H2NR1H3TRPV3MAPTALDH1A1
SCHEMBL18537881 0.79 NR1H2 (0.53) NR1H2NR1H3
SCHEMBL4242068 0.79 NR1H2 (0.40) NR1H2NR1H3ACLYCCR2TRPV3

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-12187728-B2 Caffeine inhibitors of MTHFD2 and uses thereof RAZE THERAPEUTICS, INC. (US) 2025-01-07 US disclosed
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF RAZE THERAPEUTICS, INC. 2023-03-02 US disclosed
US-11370792-B2 Caffeine inhibitors of MTHFD2 and uses thereof RAZE THERAPEUTICS, INC. (US) 2022-06-28 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 (3 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-12187728-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 NR1H2 2475/4885NR1H3 2703/4885L3MBTL1 2685/4885
US-11370792-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 NR1H2 2475/4885NR1H3 2703/4885L3MBTL1 2685/4885
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 NR1H2 2475/4885NR1H3 2703/4885L3MBTL1 2685/4885

“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.