SCHEMBL77054

SCHEMBL77054

NCC1(NCc2ccccc2)COC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.41
MAPT P10636 3/20 0.39
CYP3A4 P08684 2/20 0.39
TDP1 Q9NUW8 2/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
KDM4E B2RXH2 3/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
HSD17B10 Q99714 2/20 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
SCHEMBL14690574 0.86 IDO1 (0.38) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL17829153 0.84 NPFFR1 (0.35) IDO1MAPTCYP3A4TSHRALDH1A1
SCHEMBL29360870 0.84 MAOA (0.38) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL14999534 0.83 IDO1 (0.38) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL17459841 0.82 IDO1 (0.41) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL9954933 0.80 DPP4 (0.44) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL31310044 0.79 IDO1 (0.38) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL27777487 0.79 MMP8 (0.42) IDO1MAPTCYP3A4TDP1THRB
SCHEMBL15824244 0.79 DPP4 (0.43) IDO1MAPTCYP3A4KMT2ATSHR
SCHEMBL14690401 0.78 KDM4E (0.42) IDO1MAPTCYP3A4TDP1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118893885-B Composite film bag with foaming layer for packaging facial mask and preparation method thereof 河北北人新材科技股份有限公司 2025-02-18 CN claimed
CN-118893885-A Composite film bag with foaming layer for packaging facial mask and preparation method thereof 河北北人新材科技股份有限公司 2024-11-05 CN claimed
CN-117624747-A High-strength steel wire rope core conveyer belt and preparation method thereof 河北一川胶带集团有限公司 2024-03-01 CN claimed
CN-118893885-B Composite film bag with foaming layer for packaging facial mask and preparation method thereof 河北北人新材科技股份有限公司 2025-02-18 CN disclosed
CN-118893885-A Composite film bag with foaming layer for packaging facial mask and preparation method thereof 河北北人新材科技股份有限公司 2024-11-05 CN disclosed
CN-117624747-A High-strength steel wire rope core conveyer belt and preparation method thereof 河北一川胶带集团有限公司 2024-03-01 CN disclosed
CN-117624747-A High-strength steel wire rope core conveyer belt and preparation method thereof 河北一川胶带集团有限公司 2024-03-01 CN disclosed
US-RE49481-E1 Compounds for the treatment and prophylaxis of respiratory syncytial virus disease HOFFMANN-LA ROCHE INC. (US) 2023-04-04 US disclosed
CN-103717589-B For treating or prevent the compound of respiratory syncytial virus disease 弗·哈夫曼-拉罗切有限公司 2016-08-17 CN disclosed
EP-2742039-B1 COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS DISEASE HOFFMANN LA ROCHE (CH) 2015-09-16 EP disclosed
US-8871756-B2 Compounds for the treatment and prophylaxis of Respiratory Syncytial Virus disease HOFFMANN-LA ROCHE INC. (US) 2014-10-28 US disclosed
EP-2742039-A1 COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS DISEASE F. Hoffmann-La Roche AG (CH) 2014-06-18 EP disclosed
US-20130196974-A1 COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS DISEASE HOFFMANN-LA ROCHE INC. 2013-08-01 US disclosed
WO-2013020993-A1 COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2013-02-14 WO disclosed
US-8129423-B2 1-Adamantan-2-yl-3-benzyl-1,3-dihydro-imidazol-2-one; 11beta-hydroxysteroid dehydrogenases (11beta-HSD) inhibitor; antidiabetic, hypotensive, hypoglycemic agent; resist hyperglycemia provoked by obesity or stress; HOFFMAN-LA ROCHE INC. (US) 2012-03-06 US disclosed
EP-2308851-A1 Imidazolone and imidazolidinone derivatives as 11B-HSD1 inhibitors for the treatment of diabetes F. Hoffmann-La Roche AG (CH) 2011-04-13 EP disclosed
EP-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP disclosed
US-20080103183-A1 NEW IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN-LA ROCHE INC. 2008-05-01 US disclosed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 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 (2 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-20080103183-A1 NEW IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HSD11B1, HSD17B1, HSD17B11 IDO1 938/4885MAPT 3537/4885CYP3A4 63/4885
US-20130196974-A1 COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS DISEASE CFTR, H1-10, RECQL IDO1 4159/4885MAPT 4392/4885CYP3A4 2806/4885

“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.