SCHEMBL4092209

SCHEMBL4092209

CN(c1nc(-c2ccc(Cl)cc2Cl)nc2ccccc12)C1CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.53
MAPK1 P28482 3/20 0.53
TSHR P16473 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GBA1 P04062 8/20 0.50
CHEK2 O96017 1/20 0.50
LMNA P02545 3/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 1/20 0.44
MCL1 Q07820 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CYP1A2 P05177 4/20 0.43
CYP2D6 P10635 4/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
CYP2C9 P11712 1/20 0.43
GUSB P08236 1/20 0.43

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
SCHEMBL4092997 0.82 GBA1 (0.61) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL4090611 0.79 PDE5A (0.63) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL2335355 0.76 CHEK2 (0.78) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL2335352 0.76 CHEK2 (0.78) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL13300275 0.75 CYP1A2 (0.47) MAPK1TSHRGBA1LMNAMAPT
SCHEMBL3110092 0.75 METAP1 (0.54) MAPK1TSHRSMN1; SMN2LMNAMAPT
SCHEMBL3116679 0.75 POLB (0.50) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL3110891 0.75 POLB (0.50) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL3110893 0.75 POLB (0.50) POLBMAPK1TSHRSMN1; SMN2GBA1
SCHEMBL13609674 0.75 POLB (0.50) POLBMAPK1TSHRSMN1; SMN2GBA1

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 2 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
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 POLB 4057/4885MAPK1 2435/4885TSHR 3396/4885

“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.