SCHEMBL26119328

SCHEMBL26119328

N#CC(N)c1cncc2cccnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.37
▸ LMNA P02545 4/20 0.37
▸ MAPT P10636 3/20 0.37
▸ HTT P42858 3/20 0.37
▸ TP53 P04637 2/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ MMP2 P08253 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ CCR1 P32246 2/20 0.37
▸ CCR5 P51681 2/20 0.37
▸ CCR8 P51685 2/20 0.37
▸ HSP90AA1 P07900 2/20 0.37
▸ GMNN O75496 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ THPO P40225 1/20 0.37
▸ MTOR P42345 1/20 0.37

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
SCHEMBL26120814 0.93 KDM4E (0.34) KDM4ELMNAMAPTHTTTP53
SCHEMBL27317559 0.81 CCR1 (0.37) KDM4ELMNAMAPTHTTTP53
SCHEMBL27317555 0.81 CCR1 (0.37) KDM4ELMNAMAPTHTTTP53
SCHEMBL27317244 0.81 CCR1 (0.37) KDM4ELMNAMAPTHTTTP53
SCHEMBL27234578 0.76 PRKCZ (0.40) KDM4ELMNAHTTCYP3A4CYP2D6
SCHEMBL15472197 0.75 CCR1 (0.43) KDM4ELMNAMAPTHTTTP53
SCHEMBL29874834 0.75 CCR1 (0.43) KDM4ELMNAMAPTHTTTP53
SCHEMBL27320207 0.72 HTT (0.41) KDM4ELMNAHTTCYP3A4CYP2D6
SCHEMBL8229220 0.71 HTT (0.47) KDM4ELMNAMAPTHTTTP53
SCHEMBL30430370 0.71 ADORA2A (0.31) LMNAHTTCYP3A4CYP2D6NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4605386-A1 ANTI-VIRAL COMPOUNDS Aligos Therapeutics, Inc. (US) 2025-08-27 — — EP disclosed
US-20240182444-A1 ANTI-VIRAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2024-06-06 — — US disclosed
WO-2024102986-A2 SARS-COV-2 MPRO INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM (US) 2024-05-16 — — WO disclosed
WO-2024102986-A2 SARS-COV-2 MPRO INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM (US) 2024-05-16 — — WO disclosed
WO-2024086111-A1 ANTI-VIRAL COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2024-04-25 — — WO disclosed
WO-2023180189-A1 MPRO TARGETING ANTIVIRAL COMPOUNDS EXSCIENTIA AI LIMITED (GB) 2023-09-28 — — WO disclosed
WO-2023044171-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2023-03-23 — — WO 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-20240182444-A1 ANTI-VIRAL COMPOUNDS EIF2AK2, ZC3HAV1, HAVCR2 KDM4E 3205/4885LMNA 920/4885MAPT 1485/4885

“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.

Send feedback