SCHEMBL20970005

SCHEMBL20970005

Cc1cccc(Cn2c(N)nc3[nH]cnc3c2=O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PNP P00491 1/20 0.44
▸ KMT2A Q03164 4/20 0.42
▸ TNIK Q9UKE5 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.40
▸ POLB P06746 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ RGS12 O14924 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ LMNA P02545 4/20 0.40
▸ HTT P42858 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ PIN1 Q13526 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ ATM Q13315 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ GFER P55789 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
SCHEMBL3305583 0.88 PNP (0.39) L3MBTL1PNPKMT2AALDH1A1POLB
SCHEMBL9234445 0.86 PNP (0.44) L3MBTL1PNPKMT2ATNIKALDH1A1
SCHEMBL3303803 0.85 PNP (0.44) L3MBTL1PNPKMT2AALDH1A1POLB
SCHEMBL18247 0.85 PNP (0.59) PNPKMT2AALDH1A1POLBMEN1
Hydrochloric Acid SCHEMBL17186488 0.84 PNP (0.43) L3MBTL1PNPKMT2AALDH1A1POLB
SCHEMBL1980958 0.84 PNP (0.57) PNPKMT2AALDH1A1POLBMEN1
SCHEMBL4966788 0.82 PNP (0.44) PNPKMT2AALDH1A1POLBMEN1
SCHEMBL17186469 0.82 SOS1 (0.39) L3MBTL1PNPKMT2AALDH1A1POLB
SCHEMBL1262618 0.82 PNP (0.45) L3MBTL1PNPKMT2AALDH1A1POLB
Hydrochloric Acid SCHEMBL17186518 0.81 PNP (0.44) PNPKMT2AALDH1A1POLBMEN1

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
US-10981913-B2 11C -labeled 06 -benzylguanine, pet probe capable of visualizing 06-methyl guanine methyl-transferase activity, and production method of the same NATIONAL CENTER FOR GERIATRICS AND GERONTOLOGY (JP) 2021-04-20 — — US disclosed
EP-3483160-B1 METHOD FOR PRODUCING A 11C-LABELLED O6-BENZYLGUANINE NAT CT GERIATRICS & GERONTOLOGY (JP) 2020-11-18 — — EP disclosed
US-20190308974-A1 11C -LABELED O6 -BENZYLGUANINE, PET PROBE CAPABLE OF VISUALIZING O6 -METHYL GUANINE METHYL-TRANSFERASE ACTIVITY, AND PRODUCTION METHOD OF THE SAME NATIONAL CENTER FOR GERIATRICS AND GERONTOLOGY (JP) 2019-10-10 — — US disclosed
EP-3483160-A1 11C-LABELLED O6-BENZYLGUANINE, POSITRON EMISSION TOMOGRAPHY (PET) PROBE CAPABLE OF VISUALIZING O6-METHYL GUANINE METHYL-TRANSFERASE ACTIVITY, AND PRODUCTION METHODS THEREFOR National Center for Geriatrics and Gerontology (JP) 2019-05-15 — — EP 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-20190308974-A1 11C -LABELED O6 -BENZYLGUANINE, PET PROBE CAPABLE OF VISUALIZING O6 -METHYL GUANINE METHYL-TRANSFERASE ACTIVITY, AND PRODUCTION METHOD OF THE SAME DIMT1, ICMT, NUDT1 L3MBTL1 79/4885PNP 250/4885KMT2A 438/4885
US-10981913-B2 11C -labeled 06 -benzylguanine, pet probe capable of visualizing 06-methyl guanine methyl-transferase activity, and production method of the same DIMT1, MPG, NUDT1 L3MBTL1 116/4885PNP 189/4885KMT2A 432/4885

“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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