SCHEMBL18990640

SCHEMBL18990640

Cc1c(Cn2c(=O)c3c(nc(Br)n3C)n(C)c2=O)n(C(=O)O)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.48
▸ ALDH1A1 P00352 6/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ RAB9A P51151 1/20 0.47
▸ TNF P01375 1/20 0.47
▸ TSHR P16473 4/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ HIF1A Q16665 3/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ MAPT P10636 2/20 0.43
▸ PKM P14618 2/20 0.43
▸ STAT6 P42226 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43

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
SCHEMBL18990652 0.87 TNF (0.45) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL29631800 0.87 TNF (0.45) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL18990754 0.82 ALDH1A1 (0.46) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL18990394 0.82 RAB9A (0.47) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL18989717 0.80 ALDH1A1 (0.49) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL18990726 0.78 ALDH1A1 (0.43) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL18990090 0.78 ALDH1A1 (0.43) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL18989975 0.78 MEN1 (0.44) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL29631913 0.78 MEN1 (0.44) LMNAALDH1A1KDM4ERAB9ATNF
SCHEMBL29631996 0.75 TNF (0.43) LMNAALDH1A1KDM4ERAB9ATNF

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 LMNA 3559/4885ALDH1A1 260/4885KDM4E 1934/4885
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 LMNA 3559/4885ALDH1A1 260/4885KDM4E 1934/4885
US-20180370972-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 LMNA 3559/4885ALDH1A1 260/4885KDM4E 1934/4885

“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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