SCHEMBL25752605

SCHEMBL25752605

C/C=N\c1cccnc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 3/20 0.41
GAA P10253 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
TERT O14746 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
NPC1 O15118 2/20 0.34
HSP90AA1 P07900 1/20 0.34
P2RX7 Q99572 1/20 0.34
CYP2C9 P11712 1/20 0.33
APLNR P35414 1/20 0.33
PLAU P00749 1/20 0.32
CYP2A6 P11509 1/20 0.32
LMNA P02545 2/20 0.32

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
SCHEMBL16587282 0.82 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL25752603 0.82 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL23563157 0.79 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL20613136 0.79 KMT2A (0.38) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL22889680 0.79 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL24754894 0.78
SCHEMBL7003109 0.78 L3MBTL1 (0.39) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL23384471 0.78 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL9804987 0.77 ALDH1A1 (0.55) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL10660840 0.76

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-20230197361-A1 CONDUCTIVE TWO-DIMENSIONAL (2D) COVALENT ORGANIC FRAMEWORKS (COFS) AND METHOD OF MAKING AN ELECTRODE MATERIAL UNIV KING ABDULLAH SCI & TECH (SA) 2023-06-22 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-20230197361-A1 CONDUCTIVE TWO-DIMENSIONAL (2D) COVALENT ORGANIC FRAMEWORKS (COFS) AND METHOD OF MAKING AN ELECTRODE MATERIAL TET3, TET1, ALKBH2 ALDH1A1 579/4885MEN1 4827/4885KMT2A 214/4885

“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.