SCHEMBL6643431

SCHEMBL6643431

Nc1nc(-c2cccc(CO)c2)cc(-c2cc(-c3ccc(O)cc3)ccc2O)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ MAPK10 P53779 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ FGFR1 P11362 1/20 0.46
▸ ACMSD Q8TDX5 1/20 0.43
▸ PRKCI P41743 1/20 0.43
▸ HTR1A P08908 1/20 0.40
▸ GPR68 Q15743 1/20 0.40
▸ MMP3 P08254 1/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ ADORA2A P29274 3/20 0.39
▸ FYN P06241 2/20 0.39
▸ IKBKB O14920 1/20 0.39

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
SCHEMBL6642648 0.88 MEN1 (0.49) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6641450 0.85 MEN1 (0.52) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6640313 0.81 SMN1; SMN2 (0.50) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6642283 0.79 MEN1 (0.54) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6642887 0.78 TDP1 (0.51) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6640763 0.76 NPC1 (0.46) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL8476599 0.76 ESR1 (0.64) MEN1KMT2ACYP2C9FGFR1ACMSD
SCHEMBL6637115 0.75 GUSB (0.51) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6642377 0.74 MEN1 (0.45) MEN1KMT2ALMNACYP1A2MAPT
SCHEMBL6638090 0.74 HSP90AA1 (0.49) MEN1KMT2ALMNACYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1412327-A2 INHIBITORS OF PROTEIN KINASE FOR THE TREATMENT OF DISEASE LG Biomedical Institute (US) 2004-04-28 — — EP claimed
WO-2002096867-A2 INHIBITORS OF PROTEIN KINASE FOR THE TREATMENT OF DISEASE LG BIOMEDICAL INSTITUTE (US) 2002-12-05 — — WO claimed
US-20030208067-A1 Inhibitors of protein kinase for the treatment of disease LG BIOMEDICAL INSTITUTE 2003-11-06 — — US disclosed
US-20030187007-A1 Inhibitors of protein kinase for the treatment of disease LG BIOMEDICAL INSTITUTE 2003-10-02 — — 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 (2 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-20030208067-A1 Inhibitors of protein kinase for the treatment of disease MAP3K20, MAP3K1, MAP3K2 MEN1 2839/4885KMT2A 1417/4885LMNA 1364/4885
US-20030187007-A1 Inhibitors of protein kinase for the treatment of disease MAP3K20, MAP3K1, MAP3K2 MEN1 2839/4885KMT2A 1417/4885LMNA 1364/4885

“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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