SCHEMBL6771645

SCHEMBL6771645

CC(C)(C)OC(=O)n1cnc(CC#N)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.38
NR1H2 P55055 2/20 0.38
CTSK P43235 1/20 0.36
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NR1H3 Q13133 1/20 0.32
FAAH O00519 1/20 0.32
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32

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
SCHEMBL18950459 0.82 GPR119 (0.36) GPR119FAAH
SCHEMBL4145435 0.82 GPR119 (0.36) GPR119NR1H2FAAH
SCHEMBL2800325 0.81 GPR119 (0.35) GPR119MEN1KMT2AFAAH
SCHEMBL2490063 0.81 FAAH (0.43) GPR119MEN1ALDH1A1KMT2AFAAH
SCHEMBL27746941 0.79 CYP2C9 (0.47) GPR119FAAH
SCHEMBL6172065 0.79 GPR119 (0.35) GPR119NR1H2ALDH1A1FAAH
SCHEMBL6555078 0.79 L3MBTL1 (0.35) GPR119ALDH1A1FAAH
SCHEMBL7283194 0.79 GPR119 (0.33) GPR119CTSKFAAH
SCHEMBL20759177 0.78 CPB2 (0.39) GPR119MEN1KMT2AFAAH
SCHEMBL31326623 0.78 FAAH (0.35) GPR119NR1H2MEN1KMT2AFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040171844-A1 Dihydro-2H-naphthalene-1-one inhibitors of ras farnesyl transferase LEONARD DANIELE MARIE (US) 2004-09-02 US disclosed
US-20040063770-A1 Method for treating Alzheimer's disease WARNER-LAMBERT COMPANY 2004-04-01 US disclosed
US-20030232790-A1 Dihydro-2h-napthalene-1-one inhibitors of ras farnesyl transferase WARNER-LAMBERT COMPANY 2003-12-18 US disclosed
EP-1276724-A2 DIHYDRO-2H-NAPHTHALENE-1-ONE INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2003-01-22 EP disclosed
US-20010051642-A1 Method for treating Alzheimer's disease AHN KYUNGHYE (US) 2001-12-13 US disclosed
WO-2001079179-A2 DIHYDRO-2H-NAPHTHALENE-1-ONE INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2001-10-25 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 (4 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-20040171844-A1 Dihydro-2H-naphthalene-1-one inhibitors of ras farnesyl transferase NRAS, HRAS, FNTB GPR119 701/4885NR1H2 5/4885CTSK 2594/4885
US-20040063770-A1 Method for treating Alzheimer's disease BACE1, BACE2, PSEN1 GPR119 1105/4885NR1H2 14/4885CTSK 1427/4885
US-20010051642-A1 Method for treating Alzheimer's disease BACE1, BACE2, PSEN1 GPR119 1105/4885NR1H2 14/4885CTSK 1427/4885
US-20030232790-A1 Dihydro-2h-napthalene-1-one inhibitors of ras farnesyl transferase NRAS, FNTA, CYP46A1 GPR119 2510/4885NR1H2 31/4885CTSK 1529/4885

“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.