SCHEMBL6640313

SCHEMBL6640313

Nc1nc(-c2cc(-c3ccc(O)cc3)ccc2O)cc(-c2ccccc2CO)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ USP7 Q93009 4/20 0.40
▸ NPC1 O15118 1/20 0.38
▸ PIM1 P11309 3/20 0.38
▸ ADORA2A P29274 4/20 0.38
▸ HTR2B P41595 1/20 0.38
▸ GPR68 Q15743 1/20 0.38
▸ ADORA1 P30542 4/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CHEK1 O14757 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
SCHEMBL6642648 0.82 MEN1 (0.49) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6643431 0.81 MEN1 (0.48) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6640744 0.80 HRH4 (0.45) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6642283 0.79 MEN1 (0.54) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6640763 0.78 NPC1 (0.46) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6641450 0.77 MEN1 (0.52) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6643416 0.76 HRH4 (0.46) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6639358 0.76 CDK1 (0.54) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6638090 0.76 HSP90AA1 (0.49) SMN1; SMN2MEN1KMT2ACYP1A2MAPT
SCHEMBL6640942 0.75 EGFR (0.45) SMN1; SMN2MEN1KMT2ACYP1A2MAPT

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 3 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 SMN1; SMN2 2397/4885MEN1 2839/4885KMT2A 1417/4885

“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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