SCHEMBL6172976

SCHEMBL6172976

Brc1cn(-c2ccccn2)cn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 1/20 0.41
GRM5 P41594 1/20 0.40
EGLN2 Q96KS0 1/20 0.39
CPB2 Q96IY4 5/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CPB1 P15086 1/20 0.39
PLD1 Q13393 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
AR P10275 1/20 0.37
EP300 Q09472 1/20 0.37
KAT2B Q92831 1/20 0.37
RAB9A P51151 1/20 0.36
ALKBH2 Q6NS38 1/20 0.36
EGLN1 Q9GZT9 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
SCHEMBL30337851 1.00 SMN1; SMN2 (0.43) SMN1; SMN2POLBGRM5EGLN2CPB2
SCHEMBL31095576 0.77 NOS3 (0.45) SMN1; SMN2POLBGRM5EGLN2CPB2
SCHEMBL22199029 0.77 EGLN2 (0.60) SMN1; SMN2POLBGRM5EGLN2CPB2
SCHEMBL2159955 0.77 NOS3 (0.45) SMN1; SMN2POLBGRM5EGLN2CPB2
SCHEMBL5792550 0.76 NPC1 (0.60) SMN1; SMN2POLBGRM5EGLN2ALDH1A1
SCHEMBL16038927 0.74 NPC1 (0.53) GRM5CPB2HTTCPB1MEN1
SCHEMBL5100117 0.73 GRM5 (0.47) SMN1; SMN2POLBGRM5ALDH1A1HTT
SCHEMBL27381147 0.73 GRIN2D (0.38) CPB2ALDH1A1ARRAB9A
SCHEMBL22185839 0.73 CPB2 (0.44) SMN1; SMN2POLBGRM5EGLN2CPB2
SCHEMBL20743016 0.73 PDE10A (0.45) SMN1; SMN2POLBCPB2PLD1

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117418280-A Nickel spraying plating solution, preparation method and electroplating method 昆山一鼎工业科技有限公司 2024-01-19 CN claimed
CN-115976586-A Positive and negative pulse electrolytic nickel-tungsten alloy solution, preparation method, electroplating method and nickel-tungsten alloy coating 昆山一鼎工业科技有限公司 2023-04-18 CN claimed
CN-117418280-A Nickel spraying plating solution, preparation method and electroplating method 昆山一鼎工业科技有限公司 2024-01-19 CN disclosed
CN-115976586-A Positive and negative pulse electrolytic nickel-tungsten alloy solution, preparation method, electroplating method and nickel-tungsten alloy coating 昆山一鼎工业科技有限公司 2023-04-18 CN disclosed
US-10640510-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof SUNOVION PHARMACEUTICALS INC. (US) 2020-05-05 US disclosed
US-10640510-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof SUNOVION PHARMACEUTICALS INC. (US) 2020-05-05 US disclosed
US-20200079778-A9 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF SUNOVION PHARMACEUTICALS INC. 2020-03-12 US disclosed
US-20190135815-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2019-05-09 US disclosed
US-20190135815-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2019-05-09 US disclosed
US-10196399-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof SUNOVION PHARMACEUTICALS INC. (US) 2019-02-05 US disclosed
US-10196399-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof SUNOVION PHARMACEUTICALS INC. (US) 2019-02-05 US disclosed
EP-2694495-A1 1,4-OXAZEPINES AS BACE1 AND/OR BACE2 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-02-12 EP disclosed
WO-2012170845-A2 METABOTROPIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF HEFFERNAN MICHELE L R (US) 2012-12-13 WO disclosed
WO-2012136603-A1 1,4-OXAZEPINES AS BACE1 AND/OR BACE2 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-10-11 WO disclosed
US-20120253035-A1 1,4-OXAZEPINES AS BACE1 AND/OR BACE2 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-10-04 US disclosed
EP-1458385-A4 HETEROARYL SUBSTITUTED IMIDAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 MERCK & CO INC (US) 2005-12-21 EP disclosed
US-20040259917-A1 Heteroaryl substituted imidazole modulators of metabotropic glutamate receptor-5 COSFORD NICHOLAS D P (US) 2004-12-23 US disclosed
EP-1458385-A2 HETEROARYL SUBSTITUTED IMIDAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 Merck & Co., Inc. (US) 2004-09-22 EP disclosed
WO-2004030637-A2 TREATMENT OF OBESITY AND OTHER DISORDERS ASSOCIATED WITH EXCESSIVE FOOD INTAKE MERCK & CO., INC. (US) 2004-04-15 WO disclosed
WO-2003053922-A2 HETEROARYL SUBSTITUTED IMIDAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 MERCK & CO., INC. (US) 2003-07-03 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 (6 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-10196399-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof GRM5, GRIK5, GRM2 SMN1; SMN2 3419/4885POLB 3328/4885GRM5 1/4885
US-20120253035-A1 1,4-OXAZEPINES AS BACE1 AND/OR BACE2 INHIBITORS BACE2, BACE1, PSEN2 SMN1; SMN2 966/4885POLB 1832/4885GRM5 814/4885
US-20040259917-A1 Heteroaryl substituted imidazole modulators of metabotropic glutamate receptor-5 GRM5, GRIK5, GRIN2C SMN1; SMN2 4520/4885POLB 3979/4885GRM5 1/4885
US-20190135815-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF GRM5, GRIK5, GRM2 SMN1; SMN2 3419/4885POLB 3328/4885GRM5 1/4885
US-20200079778-A9 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF GRM5, GRIK5, GRM2 SMN1; SMN2 3419/4885POLB 3328/4885GRM5 1/4885
US-10640510-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof GRM5, GRIK5, GRM2 SMN1; SMN2 3419/4885POLB 3328/4885GRM5 1/4885

“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.