SCHEMBL18989689

SCHEMBL18989689

Cc1ccc2c(c1)cc(Cn1c(=O)c3c(nc(CCO)n3C)n(C)c1=O)n2C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ LMNA P02545 3/20 0.38
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 2/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ TP53 P04637 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ GAA P10253 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ NPSR1 Q6W5P4 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
SCHEMBL18991131 0.91 TP53 (0.43) BRAFPIK3CGLMNAMAOBPOLB
SCHEMBL18990180 0.90 BRAF (0.43) BRAFPIK3CGMAOAMAOBMEN1
SCHEMBL18989858 0.88 ALDH1A1 (0.36) BRAFPIK3CGLMNAMAOAMAOB
SCHEMBL29631985 0.88 ALDH1A1 (0.36) BRAFPIK3CGLMNAMAOAMAOB
SCHEMBL18989917 0.87 MAOB (0.36) LMNAMAOAMAOBMEN1POLB
SCHEMBL18990681 0.85 LMNA (0.43) LMNAPOLBSMN1; SMN2TP53ALDH1A1
SCHEMBL18989895 0.80 TP53 (0.46) LMNAMAOAMAOBPOLBSMN1; SMN2
SCHEMBL18990142 0.79 TP53 (0.40) LMNAMAOAMAOBMEN1POLB
SCHEMBL18989727 0.79 TP53 (0.40) LMNAMAOAMAOBMEN1POLB
SCHEMBL18990107 0.78 TSHR (0.47) LMNAPOLBSMN1; SMN2TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20180370972-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF RAZE THERAPEUTICS, INC. 2018-12-27 — — US disclosed
EP-3389664-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF Raze Therapeutics Inc. (US) 2018-10-24 — — EP disclosed
WO-2017106352-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2017-06-22 — — 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 (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-11370792-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 BRAF 2691/4885PIK3CG 3536/4885LMNA 3559/4885
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 BRAF 2691/4885PIK3CG 3536/4885LMNA 3559/4885
US-20180370972-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 BRAF 2691/4885PIK3CG 3536/4885LMNA 3559/4885

“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.

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