SCHEMBL5266152

SCHEMBL5266152

COc1cc2[nH]c(N3C4CCCC3CC4)nc(=O)c2c(C)c1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.37
▸ KDM4E B2RXH2 7/20 0.37
▸ HTT P42858 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ POLB P06746 2/20 0.35
▸ PKM P14618 1/20 0.35
▸ FLT3 P36888 1/20 0.34
▸ TSHR P16473 4/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ CXCR6 O00574 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ CYP19A1 P11511 2/20 0.32
▸ NQO2 P16083 2/20 0.32
▸ GRIN2D O15399 1/20 0.32
▸ GRIN3B O60391 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2A Q12879 1/20 0.32

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
SCHEMBL5265367 0.79 POLB (0.33) ALDH1A1KDM4EHTTSMN1; SMN2POLB
SCHEMBL5262872 0.78 TNKS (0.35) POLBNPSR1TP53
SCHEMBL5265378 0.74 POLB (0.33) POLBTP53
SCHEMBL5261238 0.74 PDE3B (0.40) KDM4ESMN1; SMN2POLBHSD17B10CYP19A1
SCHEMBL5262020 0.74 LMNA (0.39) ALDH1A1KDM4EHTTSMN1; SMN2MAPK1
SCHEMBL5261625 0.74 DCTPP1 (0.35) ALDH1A1KDM4ESMN1; SMN2POLBHSD17B10
SCHEMBL5263197 0.74 CFD (0.43) ALDH1A1KDM4EHTTSMN1; SMN2POLB
SCHEMBL5263885 0.73 DCTPP1 (0.36) ALDH1A1KDM4EHTTSMN1; SMN2MAPK1
SCHEMBL5265799 0.73 ALDH1A1 (0.41) ALDH1A1KDM4EPKMTSHRHSD17B10
SCHEMBL5266123 0.73 MEN1 (0.50) SMN1; SMN2KMT2A

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 ALDH1A1 318/4885KDM4E 3891/4885HTT 4225/4885

“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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