SCHEMBL18990107

SCHEMBL18990107

CCOC(=O)Cc1nc2c(c(=O)n(Cc3cc4cc(Cl)ccc4n3C(=O)O)c(=O)n2C)n1C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.47
▸ POLB P06746 3/20 0.47
▸ ALDH1A1 P00352 4/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ LMNA P02545 6/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TP53 P04637 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ TNF P01375 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 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
SCHEMBL18990681 0.92 LMNA (0.43) TSHRPOLBALDH1A1HSD17B10LMNA
SCHEMBL19013584 0.90 TSHR (0.44) TSHRPOLBALDH1A1HSD17B10LMNA
SCHEMBL18989894 0.89 LMNA (0.47) TSHRPOLBALDH1A1HSD17B10LMNA
SCHEMBL18991131 0.85 TP53 (0.43) POLBALDH1A1LMNASMN1; SMN2TP53
SCHEMBL29631930 0.82 ALDH1A1 (0.40) TSHRPOLBALDH1A1HSD17B10LMNA
SCHEMBL18989727 0.82 TP53 (0.40) POLBALDH1A1LMNASMN1; SMN2TP53
SCHEMBL18990307 0.82 ALDH1A1 (0.40) TSHRPOLBALDH1A1HSD17B10LMNA
SCHEMBL19013881 0.81 POLB (0.40) TSHRPOLBALDH1A1LMNATP53
SCHEMBL18989610 0.81 MAPT (0.57) TSHRPOLBALDH1A1HSD17B10LMNA
SCHEMBL18989887 0.80 TSHR (0.50) TSHRPOLBALDH1A1HSD17B10LMNA

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 TSHR 4484/4885POLB 1467/4885ALDH1A1 260/4885
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 TSHR 4484/4885POLB 1467/4885ALDH1A1 260/4885
US-20180370972-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 TSHR 4484/4885POLB 1467/4885ALDH1A1 260/4885

“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.

Send feedback