SCHEMBL1449409

SCHEMBL1449409

CCC(=O)Nc1nc(-c2ccccc2)c(-c2nc(C)no2)s1

nearest known ligand 0.80

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 15/20 0.80
ADORA1 P30542 13/20 0.80
RORC P51449 1/20 0.49
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPK1 P28482 1/20 0.48
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL1449625 0.89 ADORA2A (1.00) ADORA2AADORA1RORC
SCHEMBL1449619 0.89 ADORA2A (0.73) ADORA2AADORA1RORCALDH1A1HSD17B10
SCHEMBL1449322 0.88 ADORA2A (1.00) ADORA2AADORA1RORCALDH1A1HSD17B10
SCHEMBL1449425 0.88 ADORA2A (0.63) ADORA2AADORA1RORCALDH1A1HSD17B10
SCHEMBL1449696 0.87 ADORA2A (1.00) ADORA2AADORA1ALDH1A1HSD17B10CYP1A2
Cyclopropane SCHEMBL15484617 0.86 ADORA2A (0.81) ADORA2AADORA1ALDH1A1HSD17B10CYP1A2
Cyclohexane SCHEMBL15484623 0.86 ADORA2A (0.81) ADORA2AADORA1ALDH1A1HSD17B10CYP1A2
SCHEMBL1449473 0.86 ADORA2A (1.00) ADORA2AADORA1ALDH1A1
SCHEMBL1450041 0.86 ADORA2A (0.78) ADORA2AADORA1ALDH1A1HSD17B10MAPK1
SCHEMBL1450236 0.85 ADORA2A (1.00) ADORA2AADORA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1794157-B1 2-ACYLAMINOTHIAZOLE DERIVATIVES LUNDBECK & CO AS H (DK) 2014-02-26 EP claimed
US-7910613-B2 2-acylaminothiazole derivatives H. LUNDBECK A/S (DK) 2011-03-22 US claimed
US-20090137642-A1 2-Acylaminothiazole Derivatives H. LUNDBECK A/S (DK) 2009-05-28 US claimed
EP-1794157-A1 2-ACYLAMINOTHIAZOLE DERIVATIVES H.Lundbeck A/S (DK) 2007-06-13 EP claimed
WO-2006032273-A1 2-ACYLAMINOTHIAZOLE DERIVATIVES H. LUNDBECK A/S (DK) 2006-03-30 WO claimed
EP-1794157-B1 2-ACYLAMINOTHIAZOLE DERIVATIVES LUNDBECK & CO AS H (DK) 2014-02-26 EP disclosed
US-7910613-B2 2-acylaminothiazole derivatives H. LUNDBECK A/S (DK) 2011-03-22 US disclosed
US-7910613-B2 2-acylaminothiazole derivatives H. LUNDBECK A/S (DK) 2011-03-22 US disclosed
US-20090137642-A1 2-Acylaminothiazole Derivatives H. LUNDBECK A/S (DK) 2009-05-28 US disclosed
US-20090137642-A1 2-Acylaminothiazole Derivatives H. LUNDBECK A/S (DK) 2009-05-28 US disclosed
EP-1799065-A1 MAKE-UP METHOD USING A MAGNETIC COMPOSITION CONTAINING AT LEAST ONE TINTING AGENT HAVING OPTICAL PROPERTIES WHICH ARE SENSITIVE TO AN EXTERNAL STIMULUS L'Oréal (FR) 2007-06-27 EP disclosed
EP-1799064-A1 METHOD FOR MAKING UP KERATINOUS MATERIALS AND KIT THEREFOR L'Oréal (FR) 2007-06-27 EP disclosed
EP-1799067-A1 MAKE-UP METHOD USING A MAGNETIC COMPOSITION CONTAINING AT LEAST ONE DIFFRACTIVE PIGMENT L'Oréal (FR) 2007-06-27 EP disclosed
EP-1794157-A1 2-ACYLAMINOTHIAZOLE DERIVATIVES H.Lundbeck A/S (DK) 2007-06-13 EP disclosed
WO-2006037905-A1 METHOD FOR MAKING UP KERATINOUS MATERIALS AND KIT THEREFOR L'OREAL (FR) 2006-04-13 WO disclosed
WO-2006037902-A1 MAKE-UP METHOD USING A MAGNETIC COMPOSITION CONTAINING AT LEAST ONE DIFFRACTIVE PIGMENT L'OREAL (FR) 2006-04-13 WO disclosed
WO-2006037903-A1 MAKE-UP METHOD USING A MAGNETIC COMPOSITION CONTAINING AT LEAST ONE TINTING AGENT HAVING OPTICAL PROPERTIES WHICH ARE SENSITIVE TO AN EXTERNAL STIMULUS L'OREAL (FR) 2006-04-13 WO disclosed
WO-2006032273-A1 2-ACYLAMINOTHIAZOLE DERIVATIVES H. LUNDBECK A/S (DK) 2006-03-30 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-20090137642-A1 2-Acylaminothiazole Derivatives ADORA2A, HTR2C, ADORA2B ADORA2A 1/4885ADORA1 7/4885RORC 1208/4885

“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.