SCHEMBL30697307

SCHEMBL30697307

[H]/N=C1/NN=C(N)/C1=N\Nc1ccccc1F

nearest known ligand 0.30

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.30
KDM4E B2RXH2 1/20 0.30
KDM4A O75164 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL26123853 1.00 KMT2A (0.30) KMT2AKDM4EKDM4AGAAMAPT
SCHEMBL26512512 0.91 KMT2A (0.32) KMT2AKDM4EKDM4AGAAMAPT
SCHEMBL26123852 0.91 KMT2A (0.32) KMT2AKDM4EKDM4AGAAMAPT
SCHEMBL26512342 0.80
SCHEMBL26512485 0.80 MAPT (0.34) KMT2AKDM4EKDM4AGAAMAPT
SCHEMBL26512490 0.76 GAA (0.33) KMT2AKDM4EGAAMAPTMEN1
SCHEMBL26512418 0.75
SCHEMBL26512428 0.75 NPC1 (0.40) NPC1ALDH1A1RAB9A
SCHEMBL26512407 0.74 BRAF (0.31) KDM4AKDM4CRAB9A
SCHEMBL26512430 0.74 ADRA2A (0.32)

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-20230321043-A1 COMPOUNDS HAVING PSEUDOMONAS ANTI-BIOFILM PROPERTIES UNIV COPENHAGEN (DK) 2023-10-12 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-20230321043-A1 COMPOUNDS HAVING PSEUDOMONAS ANTI-BIOFILM PROPERTIES GMPS, PDE11A, CGAS KMT2A 4134/4885KDM4E 3703/4885KDM4A 3275/4885

“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.