SCHEMBL4092319

SCHEMBL4092319

CC(C)(C)c1ccc(-c2nc(Nc3ccc(F)c(F)c3)c3ccccc3n2)cc1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 16/20 0.74
MAPT P10636 3/20 0.71
LMNA P02545 2/20 0.71
HPGD P15428 1/20 0.71
KDM1A O60341 2/20 0.57
PDE5A O76074 2/20 0.54
TP53 P04637 1/20 0.54
ABCB1 P08183 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ABCC1 P33527 2/20 0.54

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
SCHEMBL4085190 0.93 ABCG2 (0.74) ABCG2MAPTLMNAHPGDKDM1A
SCHEMBL4085665 0.88 ABCG2 (0.95) ABCG2MAPTLMNAKDM1APDE5A
SCHEMBL4085140 0.85 ABCG2 (0.83) ABCG2MAPTLMNAHPGDKDM1A
SCHEMBL29777076 0.83 HPGD (1.00) ABCG2MAPTLMNAHPGDPDE5A
SCHEMBL16937290 0.83 HPGD (1.00) ABCG2MAPTLMNAHPGDPDE5A
SCHEMBL8087337 0.83 ABCG2 (0.85) ABCG2MAPTLMNAKDM1APDE5A
SCHEMBL4092336 0.82 ABCG2 (0.63) ABCG2MAPTLMNAHPGDKDM1A
SCHEMBL13945462 0.81 ABCG2 (0.80) ABCG2MAPTLMNAHPGDKDM1A
SCHEMBL4095375 0.80 ABCG2 (0.74) ABCG2MAPTLMNAKDM1APDE5A
SCHEMBL6001931 0.78 ABCG2 (0.93) ABCG2MAPTLMNATP53ABCB1

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 ABCG2 3127/4885MAPT 4125/4885LMNA 2728/4885

“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.