SCHEMBL22793631

SCHEMBL22793631

Nc1ccc(C(=O)Nc2ccc(Nc3ccncc3)cn2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.72
▸ MAPT P10636 3/20 0.72
▸ KMT2A Q03164 3/20 0.60
▸ KDM4E B2RXH2 3/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ PTGS1 P23219 3/20 0.56
▸ ALDH1A1 P00352 1/20 0.53
▸ RAD52 P43351 1/20 0.53
▸ MEN1 O00255 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ APEX1 P27695 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MITF O75030 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NT5E P21589 1/20 0.48
▸ CYP2C19 P33261 1/20 0.46
▸ DNMT1 P26358 2/20 0.46
▸ GAA P10253 1/20 0.46

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
SCHEMBL12240504 0.84 POLB (1.00) POLBMAPTKMT2AKDM4EPTGS1
SCHEMBL23999498 0.84 MAPT (0.51) POLBMAPTKMT2AKDM4ERAB9A
SCHEMBL24004060 0.84 POLB (0.72) POLBMAPTKMT2AKDM4ERAB9A
SCHEMBL22242773 0.80 PTGS1 (0.77) POLBKMT2AKDM4ERAB9APTGS1
SCHEMBL25466336 0.78 DNMT1 (0.80) MAPTKMT2AKDM4ERAB9AALDH1A1
SCHEMBL11613305 0.78 POLB (0.87) POLBMAPTKMT2AKDM4EPTGS1
SCHEMBL24003821 0.77 ACVRL1 (0.62) POLBMAPTKMT2AKDM4ERAB9A
SCHEMBL30232862 0.77 ACVRL1 (0.62) POLBMAPTKMT2AKDM4ERAB9A
SCHEMBL24004063 0.77 POLB (0.66) POLBMAPTKMT2AKDM4ERAB9A
SCHEMBL23999623 0.76 KDM4E (0.85) POLBMAPTKMT2AKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200390884-A1 Methods and Compositions for Modulating AKT3 AUGUSTA UNIVERSITY 2020-12-17 — — 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-20200390884-A1 Methods and Compositions for Modulating AKT3 AKT3, PTEN, AKT2 POLB 3958/4885MAPT 4510/4885KMT2A 3165/4885

“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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