SCHEMBL4092363

SCHEMBL4092363

CC(C)(C)c1ccc(-c2nc(Nc3ccccc3Cl)c3ccccc3n2)cc1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.76
ABCG2 Q9UNQ0 11/20 0.67
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
KDM4E B2RXH2 3/20 0.54
LMNA P02545 3/20 0.54
MAPT P10636 3/20 0.54
ALDH1A1 P00352 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
HTT P42858 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TP53 P04637 2/20 0.50
KDM1A O60341 1/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL4085200 0.87 PDE5A (1.00) PDE5AABCG2MEN1KMT2AKDM4E
SCHEMBL4085665 0.83 ABCG2 (0.95) PDE5AABCG2MEN1KMT2ALMNA
SCHEMBL4092336 0.80 ABCG2 (0.63) ABCG2MEN1KMT2AKDM4ELMNA
SCHEMBL8087337 0.79 ABCG2 (0.85) PDE5AABCG2MEN1KMT2AKDM4E
SCHEMBL4090985 0.78 ABCG2 (0.71) PDE5AABCG2MEN1KMT2AKDM4E
SCHEMBL4085140 0.78 ABCG2 (0.83) PDE5AABCG2MEN1KMT2AKDM4E
SCHEMBL11824321 0.77 TP53 (0.60) ABCG2MEN1KMT2AKDM4ELMNA
SCHEMBL786730 0.77 ABCG2 (0.62) PDE5AABCG2MEN1KMT2AKDM4E
SCHEMBL13945462 0.76 ABCG2 (0.80) PDE5AABCG2MEN1KMT2AKDM4E
SCHEMBL4092319 0.75 ABCG2 (0.74) PDE5AABCG2LMNAMAPTSMN1; SMN2

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 PDE5A 1861/4885ABCG2 3127/4885MEN1 718/4885

“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.