SCHEMBL2801187

SCHEMBL2801187

COc1cc(OC[C@H]2CCCCN2Cc2ccccc2)c2c(=O)[nH]cnc2c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.47
FAAH O00519 8/20 0.43
SYK P43405 2/20 0.42
HCRTR1 O43613 1/20 0.39
OPRD1 P41143 1/20 0.39
DAGLB Q8NCG7 1/20 0.38

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
SCHEMBL2798663 0.92 FAAH (0.42) BRD4FAAHSYKOPRD1
SCHEMBL4618217 0.90 FAAH (0.45) BRD4FAAHSYKOPRD1
SCHEMBL2799815 0.82 DAGLB (0.39) BRD4DAGLB
SCHEMBL3428136 0.79 F2RL3 (0.38) BRD4DAGLB
SCHEMBL4924459 0.79 BRD4 (0.38) BRD4FAAHSYK
SCHEMBL5735308 0.75 SPHK2 (0.43)
SCHEMBL3520472 0.75 SPHK2 (0.43)
SCHEMBL14089392 0.75 CHRNB4 (0.41)
SCHEMBL2797321 0.74 CPT1A (0.36)
SCHEMBL3282936 0.71 ALDH1A1 (0.41) BRD4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168143-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB 2010-07-01 US 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-20100168143-A1 QUINAZOLINE DERIVATIVES CCNI, NQO2, MKI67 BRD4 205/4885FAAH 4290/4885SYK 3013/4885

“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.