SCHEMBL7246305

SCHEMBL7246305

COc1cc2nc(N3CCc4c(cc(OC)c(OC)c4C)C3)[nH]c(=O)c2cc1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ ADRA1B P35368 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ CYP1A1 P04798 1/20 0.42
▸ CYP1B1 Q16678 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ HBB P68871 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ PDE3B Q13370 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ HTR3A P46098 1/20 0.38
▸ HRH4 Q9H3N8 1/20 0.38
▸ TUBB4A P04350 1/20 0.38
▸ TUBB P07437 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
SCHEMBL7246316 0.90 ADRA1D (0.42) ADRA1DADRA1AADRA1BMAPTCYP1A1
SCHEMBL5880497 0.88 ADRA1D (0.40) ADRA1DADRA1AADRA1BMAPTCYP1A1
SCHEMBL5880458 0.80 ADRA1D (0.47) ADRA1DADRA1AADRA1BMAPTCYP1A1
SCHEMBL5880476 0.79 CASP1 (0.44) MAPTCYP1A1CYP1B1KDM4EGAA
SCHEMBL5880599 0.79 TNKS (0.46) MAPTCYP1A1CYP1B1KDM4ECASP1
SCHEMBL5880586 0.78 ACHE (0.52) MAPTLMNAHTR3AHRH4
SCHEMBL5880464 0.78 KDM4E (0.46) MAPTCYP1A1CYP1B1KDM4EGAA
SCHEMBL5880584 0.78 ADRA1D (0.48) ADRA1DADRA1AADRA1BMAPTKDM4E
SCHEMBL5880632 0.77 ACHE (0.43) MAPTKDM4EGAACASP1HBB
SCHEMBL5880542 0.76 CASP1 (0.43) MAPTCYP1A1CYP1B1KDM4EGAA

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-20030069230-A1 Quinazolone derivatives as alpha 1A/B adrenergic receptor antagonists SYNTEX (U.S.A.) LLC 2003-04-10 — — US claimed

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-20030069230-A1 Quinazolone derivatives as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRB2, ADRA2B ADRA1D 9/4885ADRA1A 5/4885ADRA1B 4/4885

“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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