SCHEMBL6826494

SCHEMBL6826494

Cc1nc2c(ccc3nc(-c4cccc(F)c4)cc(Cl)c32)s1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 5/20 0.39
NT5E P21589 1/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
F2RL3 Q96RI0 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL6825688 0.86 MAP4K4 (0.37) MAP4K4MAPTKDM4EMEN1KMT2A
SCHEMBL6822495 0.85 MAP4K4 (0.44) MAP4K4MAPTKDM4EMEN1KMT2A
SCHEMBL6825721 0.81 GRM1 (0.40) MAPTKDM4EMEN1KMT2ANPC1
SCHEMBL6825775 0.73 MAP4K4 (0.40) MAP4K4NT5E
SCHEMBL6822520 0.72 KDM4E (0.43) MAP4K4NT5EMAPTKDM4EMEN1
SCHEMBL28015705 0.71 KDM4E (0.38) MAPTKDM4EMEN1KMT2ANPC1
SCHEMBL16720191 0.69 KDM4E (0.38) MAPTKDM4EMEN1KMT2AL3MBTL1
SCHEMBL3835965 0.68 NPC1 (0.45) MAPTKDM4EMEN1KMT2ANPC1
SCHEMBL2165945 0.68 KDM4E (0.38) MAPTKDM4EMEN1KMT2AADORA3
SCHEMBL6825816 0.68 GRM1 (0.39) MAPTKDM4EKMT2ANPC1RAB9A

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-20040214833-A1 Tricyclic heteroaromatic compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-10-28 US disclosed
WO-2004089950-A1 TRICYCLIC HETEROAROMATIC COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-10-21 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-20040214833-A1 Tricyclic heteroaromatic compounds CYP1A1, SULT2A1, CYP1B1 MAP4K4 3740/4885NT5E 3299/4885MAPT 1759/4885

“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.