SCHEMBL16449706

SCHEMBL16449706

Cc1sc(C)c2c1C(=O)CC2(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
ALPL P05186 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9056340 0.67 KDM4E (0.36) MEN1ALPLMAPK1KMT2A
SCHEMBL16449704 0.67 BRD4 (0.38) MEN1ALPLMAPK1KMT2A
SCHEMBL16449708 0.64 UCHL1 (0.39)
SCHEMBL16284916 0.62
SCHEMBL6256987 0.60 PGR (0.44)
SCHEMBL15326774 0.59 PARP1 (0.32)
SCHEMBL6262202 0.58 PGR (0.46) MEN1KMT2A
SCHEMBL17231977 0.58
SCHEMBL18020303 0.57 DRD4 (0.34)
SCHEMBL18020305 0.57 MAPT (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160369045-A1 NOVEL FUSED NAPHTHALENE CYCLOHETERO RING COMPOUNDS, AND METHODS AND USES THEREOF CORNING INC (US) 2016-12-22 US disclosed
US-20150065722-A1 FUSED THIOPHENE DITIN MONOMERS CORNING INCORPORATED 2015-03-05 US disclosed
US-20150045560-A1 NOVEL FUSED NAPHTHALENE CYCLOHETERO RING COMPOUNDS, AND METHODS AND USES THEREOF CORNING INCORPORATED 2015-02-12 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 (2 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-20150065722-A1 FUSED THIOPHENE DITIN MONOMERS TTL, THEM6, ITK MEN1 870/4885ALPL 3134/4885MAPK1 3561/4885
US-20150045560-A1 NOVEL FUSED NAPHTHALENE CYCLOHETERO RING COMPOUNDS, AND METHODS AND USES THEREOF FDPS, PPOX, DHPS MEN1 2211/4885ALPL 3268/4885MAPK1 4617/4885

“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.