SCHEMBL18990882

SCHEMBL18990882

Cn1c(=O)n(Cc2ccc(Cl)c(Cl)c2)c(=O)c2c1ncn2CC(N)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.65
▸ LMNA P02545 4/20 0.65
▸ HTT P42858 2/20 0.65
▸ UBE2N P61088 1/20 0.65
▸ TRPA1 O75762 4/20 0.63
▸ MAPT P10636 4/20 0.52
▸ TP53 P04637 2/20 0.52
▸ MTHFD2 P13995 1/20 0.52
▸ CYP1A2 P05177 2/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ CYP2C19 P33261 2/20 0.51
▸ STAT6 P42226 1/20 0.51
▸ HIF1A Q16665 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ TSHR P16473 1/20 0.49
▸ MAPK1 P28482 1/20 0.49

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
SCHEMBL18990510 0.86 SMN1; SMN2 (0.69) SMN1; SMN2LMNAHTTUBE2NMAPT
SCHEMBL18989514 0.82 MAPK1 (0.66) SMN1; SMN2LMNAHTTUBE2NMAPT
SCHEMBL18989807 0.81 SMN1; SMN2 (0.58) SMN1; SMN2LMNAHTTMAPTTP53
SCHEMBL18990501 0.79 SMN1; SMN2 (0.60) SMN1; SMN2LMNAHTTUBE2NMAPT
SCHEMBL18989539 0.78 SMN1; SMN2 (0.61) SMN1; SMN2LMNAHTTUBE2NMAPT
SCHEMBL21861569 0.78 TRPA1 (0.77) SMN1; SMN2LMNATRPA1MAPTCYP1A2
SCHEMBL17619850 0.78 TRPA1 (1.00) SMN1; SMN2LMNATRPA1MAPTCYP1A2
SCHEMBL17619604 0.76 TRPA1 (0.70) SMN1; SMN2TRPA1HIF1APOLB
SCHEMBL18990448 0.76 SMN1; SMN2 (0.57) SMN1; SMN2LMNAHTTMAPTTP53
SCHEMBL660023 0.76 ADORA2B (0.76) SMN1; SMN2LMNATRPA1MAPTKMT2A

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 9 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-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-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
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 (4 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 SMN1; SMN2 1247/4885LMNA 3559/4885HTT 539/4885
US-11370792-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 SMN1; SMN2 1247/4885LMNA 3559/4885HTT 539/4885
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 SMN1; SMN2 1247/4885LMNA 3559/4885HTT 539/4885
US-20180370972-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 SMN1; SMN2 1247/4885LMNA 3559/4885HTT 539/4885

“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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