SCHEMBL4097902

SCHEMBL4097902

CC(=O)N1CCN(c2nc(-c3cccc(F)c3)nc3ccccc23)CC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.61
MAPT P10636 1/20 0.60
ABCG2 Q9UNQ0 4/20 0.54
TSHR P16473 3/20 0.53
CYP1A2 P05177 3/20 0.53
CYP3A4 P08684 3/20 0.53
CYP2D6 P10635 3/20 0.53
USP2 O75604 2/20 0.53
MAPK1 P28482 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53
ACP1 P24666 2/20 0.52
SMO Q99835 1/20 0.52
CNR2 P34972 1/20 0.52
NCF1 P14598 1/20 0.51

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
SCHEMBL4095774 0.87 GBA1 (0.61) GBA1MAPTABCG2TSHRCYP1A2
SCHEMBL4085133 0.87 MEN1 (0.64) GBA1MAPTABCG2TSHRCYP1A2
SCHEMBL4089767 0.84 GBA1 (0.60) GBA1MAPTTSHRCYP1A2CYP3A4
SCHEMBL4090816 0.81 HIF1A (0.68) GBA1MAPTTSHRCYP1A2CYP3A4
SCHEMBL4090401 0.81 GBA1 (0.64) GBA1MAPTABCG2TSHRCYP1A2
SCHEMBL4755935 0.80 MAPT (0.56) GBA1MAPTABCG2TSHRCYP1A2
SCHEMBL4094693 0.79 MEN1 (0.72) GBA1MAPTABCG2TSHRCYP1A2
SCHEMBL1084633 0.77 MEN1 (0.56) GBA1MAPTTSHRCYP1A2CYP3A4
SCHEMBL4097324 0.76 ABCB1 (0.70) GBA1MAPTTSHRCYP1A2CYP3A4
SCHEMBL4085201 0.76 ABCB1 (0.53) GBA1MAPTTSHRCYP1A2CYP3A4

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 4 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

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 GBA1 2059/4885MAPT 4125/4885ABCG2 3127/4885

“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.