SCHEMBL4917573

SCHEMBL4917573

CC(C)(C)OC(=O)N1CCC1c1cc(-c2cccnc2C#N)no1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 8/20 0.43
HCRTR2 O43614 8/20 0.43
USP30 Q70CQ3 3/20 0.39
GPR119 Q8TDV5 5/20 0.38
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
GRM5 P41594 2/20 0.35
UCHL1 P09936 1/20 0.35

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
SCHEMBL4917565 1.00 HCRTR1 (0.43) HCRTR1HCRTR2USP30GPR119ALOX5AP
SCHEMBL3919921 0.95 HCRTR1 (0.48) HCRTR1HCRTR2USP30UCHL1
SCHEMBL3919918 0.95 HCRTR1 (0.48) HCRTR1HCRTR2USP30UCHL1
SCHEMBL4914297 0.87 HCRTR1 (0.47) HCRTR1HCRTR2USP30GPR119ALOX5AP
SCHEMBL4914288 0.87 HCRTR1 (0.47) HCRTR1HCRTR2USP30GPR119ALOX5AP
SCHEMBL4917156 0.86 HCRTR1 (0.45) HCRTR1HCRTR2USP30GPR119GRM5
SCHEMBL4917151 0.86 HCRTR1 (0.45) HCRTR1HCRTR2USP30GPR119GRM5
SCHEMBL4917620 0.82 USP30 (0.43) HCRTR1HCRTR2USP30GPR119GRM5
SCHEMBL4917611 0.82 USP30 (0.43) HCRTR1HCRTR2USP30GPR119GRM5
SCHEMBL3916610 0.82 HCRTR1 (0.53) HCRTR1HCRTR2USP30UCHL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161278-A1 2-Azetidinyl-4-(1H-Pyrazol-3-Ylamino) Pyrimidines as Inhibitors of Insulin-Like Growth Factor-1 Receptor Activity ASTRAZENECA AB (SE) 2008-07-03 US disclosed
EP-1863797-A1 2-AZETIDINYL-4-(lH-PYRAZOL-3-YLAMINO)PYRIMIDINES AS INHIBITORS OF INSULIN-LIKE GROWTH FACTOR-I RECEPTOR ACTIVITY AstraZeneca AB (SE) 2007-12-12 EP disclosed
WO-2006100461-A1 2-AZETIDINYL-4-(lH-PYRAZOL-3-YLAMINO)PYRIMIDINES AS INHIBITORS OF INSULIN-LIKE GROWTH FACTOR-I RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2006-09-28 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-20080161278-A1 2-Azetidinyl-4-(1H-Pyrazol-3-Ylamino) Pyrimidines as Inhibitors of Insulin-Like Growth Factor-1 Receptor Activity IGF1R, IGFBP1, IGFBP2 HCRTR1 3753/4885HCRTR2 3688/4885USP30 4450/4885

“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.