SCHEMBL4096964

SCHEMBL4096964

Cc1ccccc1Cc1nc(N2CCCC2)c2ccccc2n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
L3MBTL1 Q9Y468 4/20 0.52
TSHR P16473 4/20 0.52
GAA P10253 3/20 0.52
HSD17B10 Q99714 2/20 0.52
GLA P06280 1/20 0.52
HPGD P15428 1/20 0.52
ACP1 P24666 2/20 0.51
KDM4E B2RXH2 4/20 0.50
ATM Q13315 2/20 0.50
MAPK1 P28482 2/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
TLR7 Q9NYK1 1/20 0.49
GBA1 P04062 1/20 0.48
PDE10A Q9Y233 1/20 0.47
CYP1A2 P05177 3/20 0.47
CYP3A4 P08684 3/20 0.47
ALDH1A1 P00352 3/20 0.47
CYP2D6 P10635 2/20 0.47

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
SCHEMBL4085104 0.90 ALDH1A1 (0.60) MEN1KMT2ATSHRHSD17B10KDM4E
SCHEMBL4755931 0.88 MEN1 (0.56) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL4097314 0.82 KMT2A (0.59) MEN1KMT2ATSHRGAAATM
SCHEMBL4092268 0.82 L3MBTL1 (0.63) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL27492494 0.79 KMT2A (0.64) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL4089423 0.78 NPY5R (0.59) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL4084496 0.77 L3MBTL1 (0.60) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL637946 0.77 L3MBTL1 (0.60) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL638412 0.76 L3MBTL1 (0.63) MEN1KMT2AL3MBTL1TSHRGAA
SCHEMBL4753603 0.76 ALDH1A1 (0.43) MEN1KMT2AL3MBTL1TSHRHSD17B10

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 MEN1 718/4885KMT2A 1424/4885L3MBTL1 3667/4885

“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.