SCHEMBL6539574

SCHEMBL6539574

O=C(O)c1ccc(-c2cnc3sc(-c4ccc(-c5ccccc5)cc4)nn23)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 10/20 0.53
MKNK2 Q9HBH9 10/20 0.53
FYN P06241 4/20 0.47
RARA P10276 1/20 0.46
RARB P10826 1/20 0.46
RARG P13631 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL7322460 0.89 MKNK1 (0.53) MKNK1MKNK2FYN
SCHEMBL2253452 0.87 NPSR1 (0.56) MKNK1MKNK2FYNKDM4ENPC1
SCHEMBL25421528 0.85 MKNK1 (0.72) MKNK1MKNK2
SCHEMBL2250931 0.82 FYN (0.60) MKNK1MKNK2FYNLMNANPSR1
SCHEMBL2257557 0.82 DCTPP1 (0.52) MKNK1MKNK2FYNKDM4ENPC1
SCHEMBL25260642 0.82 ITGA2B (0.46) MKNK1MKNK2RARARARBRARG
SCHEMBL7326113 0.81 RARB (0.55) MKNK1MKNK2FYNRARB
SCHEMBL6132721 0.79 RARB (0.59) MKNK1MKNK2RARB
SCHEMBL6132847 0.79 MKNK1 (0.51) MKNK1MKNK2RARB
SCHEMBL11374080 0.78 NPC1 (0.44) MKNK1MKNK2FYNKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6743776-B2 ANTIFUNGAL, BETA-1,3-GLUCAN SYNTHASE INHIBITOR, PNEUMOCYSTIS CARINII; AMIDATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-01 US disclosed
US-20020193560-A1 CYCLOHEXAPEPTIDES HAVING ANTIMICROBIAL ACTIVITY ASTELLAS PHARMA INC. (JP) 2002-12-19 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-20020193560-A1 CYCLOHEXAPEPTIDES HAVING ANTIMICROBIAL ACTIVITY NGLY1, CHIT1, MANBA MKNK1 3058/4885MKNK2 3712/4885FYN 3898/4885

“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.