SCHEMBL31714740

SCHEMBL31714740

Cc1noc2nc(Cl)nc(Cl)c12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.47
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
LMNA P02545 3/20 0.35
HTT P42858 3/20 0.35
NPSR1 Q6W5P4 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 2/20 0.32
TP53 P04637 1/20 0.32
SLC26A6 Q9BXS9 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
SCHEMBL31285809 0.83 IDO1 (0.47) IDO1ALDH1A1MAPTLMNAHTT
SCHEMBL4782884 0.83 IDO1 (0.47) IDO1ALDH1A1MAPTLMNAHTT
SCHEMBL4733727 0.69 MAPT (0.55) ALDH1A1MAPTLMNAHTTNPSR1
SCHEMBL12426299 0.68 MAPT (0.45) ALDH1A1MAPTLMNANPSR1SMN1; SMN2
SCHEMBL31714647 0.67
SCHEMBL8096184 0.67 ACHE (0.31)
SCHEMBL17498385 0.66 IDO1 (0.59) IDO1KDM4EHPGD
SCHEMBL31715201 0.65 EGFR (0.35)
SCHEMBL1703281 0.64 LMNA (0.45) IDO1ALDH1A1LMNAKDM4EMEN1
SCHEMBL29525602 0.64 IDO1 (1.00) IDO1

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-20250333424-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2025-10-30 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-20250333424-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, IRF3 IDO1 1299/4885ALDH1A1 3515/4885MAPT 2776/4885

“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.