SCHEMBL7701290

SCHEMBL7701290

Cc1ccc(N2C=NC(=O)C23CCN(Cc2ccccc2)CC3)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
POLB P06746 1/20 0.50
OPRL1 P41146 3/20 0.46
OPRM1 P35372 2/20 0.46
OPRD1 P41143 2/20 0.46
OPRK1 P41145 2/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTR7 P34969 1/20 0.45
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CXCR3 P49682 1/20 0.42
SIGMAR1 Q99720 4/20 0.42
CYP3A4 P08684 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP2D6 P10635 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL7706497 0.91 OPRL1 (0.54) POLBOPRL1OPRM1OPRD1OPRK1
SCHEMBL7706380 0.89 DRD4 (0.50) OPRL1OPRM1OPRD1OPRK1ALDH1A1
SCHEMBL16876782 0.88 CHRNA7 (0.47) LMNAOPRL1OPRM1OPRD1OPRK1
SCHEMBL16876781 0.88 OPRL1 (0.46) OPRL1OPRM1OPRD1OPRK1SIGMAR1
SCHEMBL5556020 0.88 DRD2 (0.47) LMNAOPRL1OPRM1OPRD1OPRK1
SCHEMBL8893354 0.87 SIGMAR1 (0.53) LMNAPOLBALDH1A1NPSR1MAPT
SCHEMBL21634309 0.87 CCR5 (0.45) LMNAOPRL1OPRM1OPRD1OPRK1
SCHEMBL7703855 0.87 MCHR1 (0.47) LMNAPOLBOPRL1OPRM1OPRD1
SCHEMBL16876851 0.85 RORC (0.42) OPRL1OPRM1OPRD1OPRK1CXCR3
SCHEMBL16876761 0.84 OPRL1 (0.43) LMNAPOLBOPRL1OPRM1OPRD1

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
EP-3829579-B1 1,3,8-TRIAZASPIRO COMPOUNDS AND THEIR USE AS MEDICAMENTS FOR THE TREATMENT OF REPERFUSION INJURY MARIA CECILIA HOSPITAL S P A (IT) 2023-08-02 EP disclosed
WO-2020021378-A1 1,3,8-TRIAZASPIRO COMPOUNDS AND THEIR USE AS MEDICAMENTS FOR THE TREATMENT OF REPERFUSION INJURY MARIA CECILIA HOSPITAL S.P.A. (IT) 2020-01-30 WO disclosed
US-9951046-B2 TRPA1 modulators ALGOMEDIX, INC. (US) 2018-04-24 US disclosed
US-20170001983-A1 TRPA1 MODULATORS ALGOMEDIX, INC. 2017-01-05 US disclosed
EP-0921125-B1 1,3,8-Triazaspiro[4,5]decan-4-on derivatives HOFFMANN LA ROCHE (CH) 2002-01-30 EP disclosed
US-6043366-A USEFUL IN TREATING DISORDERS INVOLVING THE ORPHANIN FQ(A SEVENTEEN AMINO ACID LONG PEPTIDE) RECEPTOR. HOFFMAN-LA ROCHE INC. (US) 2000-03-28 US disclosed
EP-0921125-A1 1,3,8-Triaza-spiro 4,5 decan-4-on derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-06-09 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-20170001983-A1 TRPA1 MODULATORS TRPA1, TRPV1, TRPV2 LMNA 3839/4885POLB 4513/4885OPRL1 8/4885

“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.