SCHEMBL5263885

SCHEMBL5263885

COc1cc2[nH]c(N3CCN(c4ncc[nH]4)CC3)nc(=O)c2c(C)c1OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DCTPP1 Q9H773 3/20 0.36
▸ TUBB4A P04350 1/20 0.35
▸ TUBB P07437 1/20 0.35
▸ TUBA3C P0DPH7 1/20 0.35
▸ TUBA1B P68363 1/20 0.35
▸ TUBA4A P68366 1/20 0.35
▸ TUBB4B P68371 1/20 0.35
▸ TUBB3 Q13509 1/20 0.35
▸ TUBB2A Q13885 1/20 0.35
▸ TUBB8 Q3ZCM7 1/20 0.35
▸ TUBA3E Q6PEY2 1/20 0.35
▸ TUBA1A Q71U36 1/20 0.35
▸ TUBA1C Q9BQE3 1/20 0.35
▸ TUBB6 Q9BUF5 1/20 0.35
▸ TUBB2B Q9BVA1 1/20 0.35
▸ TUBB1 Q9H4B7 1/20 0.35
▸ ADRA2A P08913 1/20 0.34
▸ ADRA2C P18825 1/20 0.34
▸ ADRA1D P25100 1/20 0.34
▸ ADRA1A P35348 1/20 0.34

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
SCHEMBL5259891 0.92 GFER (0.35) DCTPP1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5262954 0.83 SUV39H2 (0.38) DCTPP1NPSR1MEN1KMT2AKDM4E
SCHEMBL5266876 0.83 CDK5 (0.50) NPSR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL5264790 0.83 DCTPP1 (0.34) DCTPP1MEN1KMT2AKCNH2KDM4E
SCHEMBL5262020 0.82 LMNA (0.39) NPSR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL5264354 0.82 DCTPP1 (0.41) DCTPP1GFERNPSR1KCNH2KDM4E
SCHEMBL5265193 0.81 PDE3B (0.39) DCTPP1GFERNPSR1MEN1KMT2A
SCHEMBL5261625 0.80 DCTPP1 (0.35) DCTPP1GFERNPSR1MEN1KMT2A
SCHEMBL5263654 0.80 HTR3E (0.41) DCTPP1KMT2AKCNH2TNKSTNKS2
SCHEMBL5264473 0.80 MAPT (0.44) ADRA2CADRA1AMEN1KMT2AKCNH2

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-20050124607-A1 5-Substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC 2005-06-09 — — US claimed
EP-1644343-B1 5-SUBSTITUTED QUINAZOLINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2007-07-04 — — EP 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-20050124607-A1 5-Substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1B, ADRB2 DCTPP1 3859/4885TUBB4A 914/4885TUBB 670/4885

“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.

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