SCHEMBL24513588

SCHEMBL24513588

O=C(Nc1cc(-c2nc3ccccc3[nH]2)n[nH]1)c1c(F)cccc1F

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.63
▸ POLB P06746 2/20 0.51
▸ TP53 P04637 3/20 0.51
▸ KMT2A Q03164 4/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ HTT P42858 2/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ PDPK1 O15530 1/20 0.47
▸ NPC1 O15118 5/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ PKM P14618 2/20 0.46
▸ LMNA P02545 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
SCHEMBL22488985 0.89 MAPT (0.62) MAPTPOLBTP53KMT2AKDM4E
SCHEMBL22489155 0.88 FGFR1 (0.54) MAPTPOLBKMT2AKDM4EMEN1
SCHEMBL22488981 0.87 NPC1 (0.64) MAPTPOLBTP53KMT2AKDM4E
SCHEMBL22489123 0.85 MAPT (0.47) MAPTPOLBTP53KMT2AKDM4E
SCHEMBL24513591 0.84 NPC1 (0.60) MAPTPOLBTP53KMT2AKDM4E
SCHEMBL22489011 0.84 MMP2 (0.59) MAPTPOLBKMT2AKDM4EMEN1
SCHEMBL22488975 0.81 NPC1 (0.65) MAPTPOLBKMT2AKDM4EMEN1
SCHEMBL22489163 0.81 KDM4E (0.60) POLBTP53KMT2AKDM4EMEN1
SCHEMBL22488979 0.81 NPC1 (0.61) MAPTPOLBKMT2AKDM4EMEN1
SCHEMBL22488977 0.81 PDE10A (0.57) PDE10AFOXO1

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-20220185797-A1 SELECTIVE FOXO INHIBITORS FOR TREATMENT OF DIABETES AND OTHER DISORDERS RELATED TO IMPAIRED PANCREATIC FUNCTION THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2022-06-16 — — 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-20220185797-A1 SELECTIVE FOXO INHIBITORS FOR TREATMENT OF DIABETES AND OTHER DISORDERS RELATED TO IMPAIRED PANCREATIC FUNCTION FOXO1, FOXO3, FOXK1 MAPT 297/4885POLB 3944/4885TP53 265/4885

“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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