SCHEMBL7186238

SCHEMBL7186238

C=CCN(C)C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
HCAR2 Q8TDS4 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
CYP2C9 P11712 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
ALOX5 P09917 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33

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
SCHEMBL1632527 0.81 ALDH1A1 (0.39) ALDH1A1HCAR2CA12CA1CA2
SCHEMBL7023419 0.81 ALDH1A1 (0.48) ALDH1A1HCAR2LMNAHSD17B10ALOX15
SCHEMBL23225639 0.80 CA12 (0.35) ALDH1A1CA12CA1CA2CA9
SCHEMBL11506740 0.79 ALDH1A1 (0.38) ALDH1A1HCAR2LMNAHSD17B10ALOX15
SCHEMBL2338677 0.79 ALDH1A1 (0.38) ALDH1A1HCAR2LMNAHSD17B10ALOX15
Methyl Alcohol SCHEMBL11376423 0.79 ALDH1A1 (0.47) ALDH1A1HCAR2LMNAHSD17B10ALOX15
SCHEMBL24131731 0.79 TSHR (0.50) ALDH1A1LMNAGAAMEN1KMT2A
SCHEMBL29144627 0.78
SCHEMBL10690127 0.78
SCHEMBL12003315 0.78 ALDH1A1 (0.36) ALDH1A1HCAR2LMNAHSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6583177-B2 Amidinophenol derivatives as leukotriene B4 (LTB4)antagonists, phospholipase A2 inhibitors, and trypsin inhibitors. ONO PHARMACEUTICAL CO., LTD. (JP) 2003-06-24 US disclosed
US-20020128315-A1 Leukotriene B4 antagonist compounds and method for treatment NAKAI HISAO (JP) 2002-09-12 US disclosed
US-6262114-B1 NOVEL AMIDINOPHENOL DERIVATIVES; INHIBITORS OF PHOSPHOLIPASE A2 AND/OR TRYPSIN ONO PHARMACEUTICAL CO., LTD. (JP) 2001-07-17 US disclosed
EP-0703216-B1 Amidinophenol derivatives as protease inhibitors ONO PHARMACEUTICAL CO (JP) 1999-04-07 EP disclosed
EP-0703216-A1 Amidinophenol derivatives as protease inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 1996-03-27 EP disclosed
US-4552932-A Radiation curable polyurethanes THE B. F. GOODRICH COMPANY (US) 1985-11-12 US disclosed
US-4180505-A Novel steroidspirooxazolidines and process for their preparation Richter Gedeon Vegyeszet, Gyar RT (HU) 1979-12-25 US disclosed
US-4100143-A Filaments which may be cross-linked comprising at least 65% acrylonitrile and 0.5-10% N-methylol derivative of a urethane BAYER AKTIENGESELLSCHAFT (DE) 1978-07-11 US 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-20020128315-A1 Leukotriene B4 antagonist compounds and method for treatment LTB4R2, LTB4R, LTA4H ALDH1A1 1930/4885HCAR2 972/4885CA12 3321/4885

“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.