SCHEMBL4092273

SCHEMBL4092273

CCOC(=O)N1CCN(c2nc(-c3ccccc3Cl)nc3cccc(Cl)c23)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.53
MEN1 O00255 8/20 0.53
MAPT P10636 4/20 0.49
MAPK1 P28482 2/20 0.49
POLB P06746 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
ABCB1 P08183 1/20 0.47
ALDH1A1 P00352 2/20 0.47
TDP1 Q9NUW8 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 1/20 0.45
HTR3E A5X5Y0 1/20 0.45
HTR3B O95264 1/20 0.45
HTR3A P46098 1/20 0.45

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
SCHEMBL4090717 0.94 KMT2A (0.52) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4085044 0.93 KMT2A (0.49) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4094778 0.92 KMT2A (0.50) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4099740 0.92 KMT2A (0.50) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4090616 0.91 KMT2A (0.49) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4084354 0.90 KMT2A (0.48) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL4089674 0.90 ABCB1 (0.49) KMT2AMEN1MAPTKDM4EABCB1
SCHEMBL4095953 0.89 MEN1 (0.67) KMT2AMEN1MAPTPOLBKDM4E
SCHEMBL4090368 0.88 MEN1 (0.53) KMT2AMEN1MAPTABCB1ALDH1A1
SCHEMBL4090729 0.86 ABCB1 (0.52) KMT2AMEN1MAPTKDM4ECASP1

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-20090209536-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-08-20 US disclosed
US-20090209536-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-08-20 US disclosed
US-20090209536-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-08-20 US disclosed
WO-2008157500-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2008-12-24 WO disclosed
WO-2008157500-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2008-12-24 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-20090209536-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE CNR2, CNR1, GPR18 KMT2A 1424/4885MEN1 718/4885MAPT 4125/4885

“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.