SCHEMBL631673

SCHEMBL631673

Nc1cccc(COc2ccccc2)c1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 15/20 0.79
MAOA P21397 3/20 0.63
GAA P10253 1/20 0.63
MAPT P10636 1/20 0.63
RAB9A P51151 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
F10 P00742 1/20 0.58
APP P05067 1/20 0.57
LCK P06239 1/20 0.50
CYP4F2 P78329 1/20 0.50
CYP4A11 Q02928 1/20 0.50

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
SCHEMBL31114416 1.00 MAOB (0.79) MAOBMAOAGAAMAPTRAB9A
SCHEMBL12533272 0.90 MAOB (0.65) MAOBMAOAGAAMAPTRAB9A
3-(Benzyloxy)Aniline SCHEMBL29428912 0.89 MAOB (1.00) MAOBMAOAGAAMAPTRAB9A
3-(Benzyloxy)Aniline SCHEMBL291445 0.89 MAOB (1.00) MAOBMAOAGAAMAPTRAB9A
3-(Benzyloxy)Aniline SCHEMBL11263814 0.87 MAOB (0.96) MAOBMAOAGAAMAPTRAB9A
SCHEMBL1548932 0.86 F10 (0.62) MAOBMAOAGAAMAPTRAB9A
SCHEMBL17554431 0.85 LMNA (0.61) MAOBMAOAGAAMAPTRAB9A
SCHEMBL2168633 0.84 MAOB (0.57) MAOBMAOAGAAMAPTRAB9A
SCHEMBL21480409 0.84 MAOB (0.71) MAOBMAOAGAAMAPTRAB9A
SCHEMBL21480309 0.84 MAOB (0.64) MAOBMAOAGAAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0046445-B1 3-PHENOXY-METHYLENE ANILINES AS HERBICIDES, THEIR PREPARATION AND USE CIBA-GEIGY AG (CH) 1984-06-13 EP claimed
JP-54088231-A None JP disclosed
EP-3901162-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF AbbVie Inc. (US) 2021-10-27 EP disclosed
WO-2018068357-A1 NOVEL SIRT2 PROTEIN INHIBITOR AND PHARMACEUTICAL USE THEREOF 西华大学 2018-04-19 WO disclosed
US-8586617-B2 Aminomethyl-4-imidazoles HOFFMANN-LA ROCHE INC. (US) 2013-11-19 US disclosed
CN-101528710-B Aminomethyl-4-imidazoles HOFFMANN LA ROCHE 2012-11-07 CN disclosed
EP-2076497-B1 AMINOMETHYL-4-IMIDAZOLES HOFFMANN LA ROCHE (CH) 2012-02-22 EP disclosed
CN-101528710-A Aminomethyl-4-imidazoles HOFFMANN LA ROCHE (CH) 2009-09-09 CN disclosed
EP-2076497-A1 AMINOMETHYL-4-IMIDAZOLES F. Hoffmann-Roche AG (CH) 2009-07-08 EP disclosed
US-20080119535-A1 AMINOMETHYL-4-IMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2008-05-22 US disclosed
WO-2008046757-A1 AMINOMETHYL-4-IMIDAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 WO disclosed
EP-0290682-B1 HERBICIDAL 4,5-DIHYDRO-1H-1,2,4-TRIAZOLE-3-CARBOXAMIDE DERIVATIVES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-07-01 EP disclosed
US-4897106-A Derivative of 4,5-dihydro-1H-1,2,4-triazole-3-carboxamide, and herbicidal composition containing the derivative KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-01-30 US disclosed
EP-0290682-A2 Herbicidal 4,5-dihydro-1H-1,2,4-triazole-3-carboxamide derivatives KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-11-17 EP disclosed
EP-0128530-B1 SUBSTITUTED 4,5-DIMETHOXYPYRIDAZONES, PROCESS FOR THEIR PREPARATION, HERBICIDES CONTAINING THEM AND THEIR USE IN COMBATING THE GROWTH OF UNDESIRABLE PLANTS BASF Aktiengesellschaft (DE) 1988-04-27 EP disclosed
EP-0091639-B1 ANILINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN COMBATING THE GROWTH OF UNDESIRABLE PLANTS BASF Aktiengesellschaft (DE) 1987-06-16 EP disclosed
US-4576630-A Substituted 4,5-dimethoxypyridazones, herbicides containing these compounds, and their use for controlling undesirable plant growth BASF AKTIENGESELLSCHAFT (DE) 1986-03-18 US disclosed
EP-0128530-A1 Substituted 4,5-dimethoxypyridazones, process for their preparation, herbicides containing them and their use in combating the growth of undesirable plants BASF Aktiengesellschaft (DE) 1984-12-19 EP disclosed
EP-0091639-A2 Aniline derivatives, process for their preparation and their use in combating the growth of undesirable plants BASF Aktiengesellschaft (DE) 1983-10-19 EP disclosed
JP-S5488231-A 3-PHENYLOXYMETHYLANILINE DERIVATIVE, ITS PREPARATION, AND HERBICIDES CONSISTING OF IT SUMITOMO CHEM CO LTD 1979-07-13 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-20080119535-A1 AMINOMETHYL-4-IMIDAZOLES INMT, HTR4, MC4R MAOB 124/4885MAOA 148/4885GAA 418/4885

“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.