SCHEMBL1416007

SCHEMBL1416007

C[CH]N(C(N)=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ PARP1 P09874 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ CYP2C9 P11712 1/20 0.36

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
SCHEMBL28774233 0.84 NPSR1 (0.39) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL3258421 0.81 NPSR1 (0.43) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL4587987 0.80 ALDH1A1 (0.40) ALDH1A1TSHRMAPTCYP3A4CYP2C19
SCHEMBL11074660 0.79 NPSR1 (0.41) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL15786490 0.78 NPSR1 (0.40) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL10348319 0.76 NPSR1 (0.39) NPSR1ALOX5ALDH1A1TSHRGLA
Methyl Alcohol SCHEMBL28147253 0.71 NPSR1 (0.58) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL966681 0.71 KMT2A (0.50) NPSR1ALOX5POLBL3MBTL1KMT2A
SCHEMBL1630634 0.71 KMT2A (0.50) NPSR1ALOX5POLBL3MBTL1KMT2A
SCHEMBL75883 0.70 NPSR1 (0.64) NPSR1ALOX5ALDH1A1TSHRGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7081481-B2 Excitatory amino acid receptor modulators ELI LILLY AND COMPANY (US) 2006-07-25 — — US claimed
US-20040102521-A1 Excitatory amino acid receptor modulators ELI LILLY AND COMPANY 2004-05-27 — — US claimed
EP-1289940-A2 EXCITATORY AMINO ACID RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-03-12 — — EP claimed
WO-2001092213-A2 EXCITATORY AMINO ACID RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2001-12-06 — — WO claimed
JP-60258184-A — — None — — JP disclosed
EP-2165830-B1 Lithographic printing plate precursor and printing method using the same FUJIFILM CORP (JP) 2011-03-16 — — EP disclosed
US-20100071574-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2010-03-25 — — US disclosed
EP-2165830-A1 Lithographic printing plate precursor and printing method using the same Fujifilm Corporation (JP) 2010-03-24 — — EP disclosed
US-7081481-B2 Excitatory amino acid receptor modulators ELI LILLY AND COMPANY (US) 2006-07-25 — — US disclosed
US-20040102521-A1 Excitatory amino acid receptor modulators ELI LILLY AND COMPANY 2004-05-27 — — US disclosed
EP-1289940-A2 EXCITATORY AMINO ACID RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-03-12 — — EP disclosed
WO-2001092213-A2 EXCITATORY AMINO ACID RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2001-12-06 — — WO disclosed
JP-S60258184-A IMIDAZO(2,1-B)BENZOTHIAZOLE DERIVATIVE OR IMIDAZO(2,1-B) BENZOXAZOLE DERIVATIVE AND THEIR PREPARATION NIPPON SODA CO LTD 1985-12-20 — — JP 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-20040102521-A1 Excitatory amino acid receptor modulators GRM1, GRM2, GRIN1 NPSR1 154/4885ALOX5 1459/4885ALDH1A1 1907/4885

“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.

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