SCHEMBL4131350

SCHEMBL4131350

CC(C)CNC(=O)c1cccc(-c2ccc3c(c2)CCC(N2CCCC2)C3)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
GAA P10253 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PRMT5 O14744 5/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 2/20 0.42
MCHR1 Q99705 1/20 0.42
L3MBTL3 Q96JM7 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK14 Q16539 1/20 0.40
CNR2 P34972 1/20 0.39
ADAMTS7 Q9UKP4 1/20 0.38
FAAH O00519 1/20 0.38
ROCK2 O75116 1/20 0.38
ADRB3 P13945 1/20 0.38
ERN1 O75460 1/20 0.38
PREP P48147 1/20 0.38

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
SCHEMBL4135595 0.91 KMT2A (0.44) KMT2AGAAHSD17B10PRMT5MEN1
SCHEMBL4129127 0.86 PRKD1 (0.46) KMT2AGAASMN1; SMN2MEN1MCHR1
Formaldehyde SCHEMBL4135580 0.84 PRKD1 (0.45) GAASMN1; SMN2MCHR1ERN1
SCHEMBL4136188 0.83 MAPK14 (0.50) KMT2ASMN1; SMN2MEN1L3MBTL1MAPK14
SCHEMBL4128788 0.82 HRH3 (0.49) MCHR1L3MBTL3L3MBTL1FAAH
SCHEMBL4133418 0.81 L3MBTL3 (0.51) KMT2AGAAHSD17B10MEN1MCHR1
SCHEMBL4144270 0.80 TDP2 (0.45) L3MBTL3L3MBTL1FAAHERN1
SCHEMBL4140115 0.80 TDP2 (0.45) L3MBTL3L3MBTL1FAAHERN1
SCHEMBL4140118 0.80 TDP2 (0.45) L3MBTL3L3MBTL1FAAHERN1
SCHEMBL4136371 0.80 HRH3 (0.52) SMN1; SMN2MCHR1L3MBTL3L3MBTL1ERN1

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 KMT2A 1670/4885GAA 294/4885HSD17B10 1285/4885

“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.