SCHEMBL3583330

SCHEMBL3583330

CCOC(=O)c1ccc(CC2CCN(CC(O)(c3cn(Cc4ccccc4)c4cc([N+](=O)[O-])ccc34)C(F)(F)F)CC2)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ACHE P22303 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PLA2G4A P47712 1/20 0.36
LTB4R Q15722 1/20 0.36
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
POLB P06746 2/20 0.36
KCNJ1 P48048 1/20 0.36
HTR4 Q13639 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
SCHEMBL3587529 0.93 PLA2G4A (0.43) MEN1KMT2AACHESMN1; SMN2PLA2G4A
SCHEMBL3591661 0.91 MEN1 (0.41) MEN1KMT2AACHEALDH1A1MAPT
SCHEMBL3592312 0.90 MAPT (0.37) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL3595511 0.85 BCHE (0.36) MEN1KMT2AACHESMN1; SMN2POLB
SCHEMBL13254286 0.84 ACHE (0.41) MEN1KMT2AACHEALDH1A1
SCHEMBL3600226 0.84 MEN1 (0.50) MEN1KMT2AACHEMAPTSMN1; SMN2
SCHEMBL3596120 0.83 MEN1 (0.45) MEN1KMT2AACHEMAPTSMN1; SMN2
SCHEMBL3598453 0.83 ALDH1A1 (0.43) KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL3599652 0.83 MEN1 (0.38) MEN1KMT2AACHESMN1; SMN2POLB
SCHEMBL3587526 0.83 CCR5 (0.39) MEN1KMT2AALDH1A1PLA2G4ALTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-29 US disclosed
US-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-29 US disclosed
US-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-29 US disclosed
EP-1930320-A1 NOVEL FUSED PYRROLE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-06-11 EP disclosed
EP-1930320-A1 NOVEL FUSED PYRROLE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-06-11 EP 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-20100190768-A1 NOVEL FUSED PYROLE DERIVATIVE NR3C1, NR3C2, NR0B1 MEN1 3628/4885KMT2A 4721/4885ACHE 3194/4885

“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.