SCHEMBL1552479

SCHEMBL1552479

COc1ccc(-n2c(C(C)C(N)=O)nc3ccc(OC)cc3c2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.47
KCNH2 Q12809 1/20 0.47
HPD P32754 2/20 0.46
PDE10A Q9Y233 2/20 0.46
ALPG P10696 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.44
CXCR3 P49682 1/20 0.44

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
SCHEMBL1552456 0.92 ALDH1A1 (0.47) HRH3KCNH2HPDPDE10AALDH1A1
SCHEMBL1553204 0.91 PDE10A (0.57) HPDPDE10A
SCHEMBL4579481 0.89 ALDH1A1 (0.59) HRH3KCNH2PDE10AALDH1A1LMNA
SCHEMBL1553112 0.86 PDE10A (0.56) HRH3KCNH2PDE10AALDH1A1
SCHEMBL1553641 0.85 PDE10A (0.57) HRH3KCNH2PDE10A
SCHEMBL1553134 0.82 SMN1; SMN2 (0.63) ALDH1A1LMNA
SCHEMBL448500 0.81 ALDH1A1 (0.46) HRH3KCNH2HPDPDE10AALDH1A1
SCHEMBL1553986 0.79 HRH3 (0.48) HRH3KCNH2PDE10AALDH1A1LMNA
SCHEMBL1554244 0.79 GPR139 (0.46) HRH3KCNH2PDE10AALDH1A1LMNA
SCHEMBL1554072 0.79 HRH3 (0.48) HRH3KCNH2PDE10AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748440-B2 Quinazolinone modulators of nuclear receptors EXELIXIS, INC. (US) 2014-06-10 US claimed
EP-1521746-B1 QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS X CEPTOR THERAPEUTICS INC (US) 2011-04-27 EP claimed
US-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors X-CEPTOR THERAPEUTICS, INC. (US) 2008-03-20 US claimed
US-8748440-B2 Quinazolinone modulators of nuclear receptors EXELIXIS, INC. (US) 2014-06-10 US disclosed
US-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors X-CEPTOR THERAPEUTICS, INC. (US) 2008-03-20 US disclosed
EP-1521746-A1 QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS X-Ceptor Therapeutics, Inc. (US) 2005-04-13 EP disclosed
WO-2003076418-A1 QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS X-CEPTOR THERAPEUTICS, INC. (US) 2003-09-18 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-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors NR1H4, NR1H2, NR1H3 HRH3 886/4885KCNH2 4581/4885HPD 3916/4885

“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.